data_2rt5_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2rt5 _Structure_validation_residue.Date_analyzed 2016-10-08 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 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.592 HD11 ' HB2' ' A' 3646 ' ' LEU . 2.0 pp . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.609 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.25 -16.23 63.01 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.234 -174.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.609 ' N ' HD13 ' A' 3502 ' ' LEU . 73.6 mmtt -72.0 -25.05 61.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.312 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 85.3 mttt -104.41 -44.53 4.9 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.507 0.67 . . . . 0.0 110.511 177.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.743 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -142.47 94.33 6.81 Favored Pre-proline 0 N--CA 1.435 -1.191 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.192 -176.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -80.64 174.17 11.41 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 123.811 3.007 . . . . 0.0 113.432 -178.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.45 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.2 mt -70.57 136.81 25.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.792 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 28.6 m -108.02 -20.33 6.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.699 -177.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.745 ' HE3' HD13 ' A' 3524 ' ' LEU . 24.2 t90 -159.69 153.16 22.45 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.643 0.259 . . . . 0.0 110.388 -176.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -148.27 119.9 8.02 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 177.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -172.91 -129.65 1.17 Allowed Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.743 -0.741 . . . . 0.0 111.515 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.619 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -140.01 155.86 46.89 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.073 0.463 . . . . 0.0 111.196 -179.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.48 HD23 ' HB2' ' A' 3547 ' ' LEU . 83.2 mt -107.63 152.43 24.3 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 168.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.628 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -146.86 122.47 10.46 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.571 HD11 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.89 145.21 41.86 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 171.6 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.571 ' HD3' HD11 ' A' 3515 ' ' LEU . 0.1 OUTLIER 59.83 -96.16 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.989 0.423 . . . . 0.0 110.069 -168.352 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -143.68 8.49 1.52 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -102.35 122.42 44.22 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.14 -173.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 66.6 p -108.62 152.7 24.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.104 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -141.61 114.75 8.71 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.193 173.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.619 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -69.01 117.2 10.36 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 176.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.422 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.9 m -131.31 148.16 32.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.426 -177.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -112.57 132.88 54.91 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.042 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.745 HD13 ' HE3' ' A' 3509 ' ' TRP . 0.9 OUTLIER -100.64 113.11 25.67 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.408 0.623 . . . . 0.0 112.189 -173.087 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.45 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 83.0 m-70 -87.32 137.56 32.24 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.481 174.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.743 ' O ' ' HB2' ' A' 3505 ' ' TYR . 62.1 t80 -66.14 139.83 58.17 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 174.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.645 ' CG1' HD23 ' A' 3575 ' ' LEU . 16.2 t -116.62 -55.64 4.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.362 0.601 . . . . 0.0 111.304 175.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.412 ' HB3' ' HB3' ' A' 3575 ' ' LEU . 13.6 t -158.02 170.14 22.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.917 -169.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3529 ' ' GLY . . . . . 0.403 ' HA2' ' HB3' ' A' 3570 ' ' GLU . . . 87.03 -152.23 24.43 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.86 175.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.441 ' HB2' ' HA ' ' A' 3571 ' ' THR . 52.2 t-20 -97.95 114.58 26.73 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -64.21 -28.22 69.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.73 0.3 . . . . 0.0 111.356 -177.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 60.9 t -64.84 -31.12 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.827 0.346 . . . . 0.0 110.442 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.499 HD21 ' HD3' ' A' 3536 ' ' ARG . 18.5 mt -57.31 -39.0 74.91 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.91 176.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.441 ' HA ' HD11 ' A' 3661 ' ' ILE . . . -70.83 -44.62 66.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.852 0.358 . . . . 0.0 110.498 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 59.0 t60 -60.76 -32.51 71.81 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.023 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3536 ' ' ARG . . . . . 0.499 ' HD3' HD21 ' A' 3533 ' ' LEU . 14.1 ptm180 -89.07 -18.27 27.62 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -177.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.448 ' HB2' HG22 ' A' 3614 ' ' VAL . 42.3 p -98.66 -39.07 8.86 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 122.128 -0.357 . . . . 0.0 111.428 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.563 HD12 ' HB2' ' A' 3509 ' ' TRP . 30.6 mt -80.27 110.69 17.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.272 -174.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo . . . . . 0 N--CA 1.462 -0.325 0 C-N-CA 123.351 2.701 . . . . 0.0 112.882 -172.185 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A 3546 ' ' PRO . . . . . 0.572 ' HA ' ' O ' ' A' 3512 ' ' LEU . 15.9 Cg_endo . . . . . 0 C--O 1.234 0.289 0 CA-C-O 121.052 0.355 . . . . 0.0 112.799 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.605 ' HB3' HD12 ' A' 3612 ' ' ILE . 29.4 mt -68.92 116.4 9.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.333 177.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.628 ' HA ' ' O ' ' A' 3514 ' ' ALA . 16.9 ptt180 -90.35 139.07 31.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.36 -175.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.438 HD12 HD22 ' A' 3515 ' ' LEU . 31.7 mt -93.1 105.86 17.28 Favored 'Isoleucine or valine' 0 C--O 1.242 0.688 0 CA-C-O 122.066 0.936 . . . . 0.0 110.555 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -103.84 -14.56 15.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.45 -171.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.656 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 96.1 mt-30 -146.78 177.65 8.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.697 -177.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.731 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -152.82 140.95 20.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 0.0 111.689 -178.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.54 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 17.2 ttt -111.41 110.48 20.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.727 176.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -61.67 110.7 1.58 Allowed 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.497 ' O ' HD12 ' A' 3555 ' ' LEU . 2.4 pp -75.2 98.82 3.84 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.007 0.908 . . . . 0.0 110.023 -176.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.699 ' O ' ' HG ' ' A' 3560 ' ' LEU . 33.6 mt-10 -101.54 162.59 12.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.122 174.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.488 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -59.9 -38.02 81.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.138 0.494 . . . . 0.0 109.805 177.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 3.1 p -66.98 -41.08 87.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.162 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.664 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 77.6 mm-40 -63.68 -42.93 97.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.068 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' 3556 ' ' GLU . 78.2 mt -60.83 -32.93 72.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.315 -178.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.617 ' O ' ' HD3' ' A' 3565 ' ' ARG . 10.9 mm-40 -60.95 -50.78 71.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.211 0.529 . . . . 0.0 109.72 173.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.28 -41.48 99.52 Favored Glycine 0 N--CA 1.452 -0.248 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.067 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' 3559 ' ' GLN . 69.3 t -60.47 -48.28 89.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 176.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.69 76.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.247 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.617 ' HD3' ' O ' ' A' 3561 ' ' GLU . 5.1 mpt_? -59.45 -41.73 90.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.236 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 24.7 ptt180 -88.2 -9.93 51.47 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.724 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.516 ' HG3' ' O ' ' A' 3563 ' ' VAL . 84.5 mtp -83.22 -29.41 28.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.939 0.4 . . . . 0.0 110.531 176.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3568 ' ' THR . . . . . 0.476 HG23 ' O ' ' A' 3565 ' ' ARG . 7.0 t -75.41 -15.1 60.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.065 0.46 . . . . 0.0 110.228 -178.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 46.0 t -103.12 87.0 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.958 177.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3570 ' ' GLU . . . . . 0.403 ' HB3' ' HA2' ' A' 3529 ' ' GLY . 45.3 mt-10 -74.4 107.64 6.68 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.441 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.1 m 155.68 -42.11 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 125.227 1.411 . . . . 0.0 107.662 -172.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.03 -30.91 31.23 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.48 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.84 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.1 OUTLIER -126.67 164.03 22.19 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.201 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.577 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 38.3 t -127.59 135.59 50.49 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 171.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.645 HD23 ' CG1' ' A' 3527 ' ' VAL . 12.8 tp -106.27 125.8 51.44 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.507 HD13 HD21 ' A' 3524 ' ' LEU . 79.4 mt -127.59 154.66 44.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.158 0.504 . . . . 0.0 110.693 -177.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.698 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.4 OUTLIER -119.75 109.76 15.99 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.135 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.473 ' HB3' HD12 ' A' 3659 ' ' ILE . . . -94.55 119.74 33.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.366 0.603 . . . . 0.0 110.391 -179.206 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.493 ' HG ' HD11 ' A' 3577 ' ' LEU . 59.0 mt -119.4 142.92 33.4 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 114.721 -1.127 . . . . 0.0 109.987 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.65 113.35 1.52 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.437 2.091 . . . . 0.0 111.612 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.5 p -96.38 106.01 18.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.483 0.659 . . . . 0.0 110.448 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -102.09 147.72 17.42 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.652 178.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 48.1 ttp180 -58.75 -43.47 90.3 Favored 'General case' 0 N--CA 1.428 -1.558 0 CA-C-O 121.371 0.605 . . . . 0.0 110.421 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.597 ' O ' HG21 ' A' 3588 ' ' VAL . 3.9 p30 -142.23 177.77 8.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.012 -0.995 . . . . 0.0 108.97 178.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3585 ' ' GLN . . . . . 0.414 ' O ' HG23 ' A' 3589 ' ' VAL . 64.4 tt0 -51.93 -46.36 64.64 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.512 0.508 . . . . 0.0 111.53 -176.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -62.57 -46.66 87.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.409 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 22.8 t70 -60.54 -41.43 94.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.06 0.457 . . . . 0.0 110.632 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.597 HG21 ' O ' ' A' 3584 ' ' ASP . 96.1 t -57.54 -45.27 86.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.574 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3589 ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' 3585 ' ' GLN . 83.0 t -57.76 -46.16 86.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.697 178.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 14.3 t -64.09 -42.88 96.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.724 -178.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3591 ' ' GLN . . . . . 0.554 ' NE2' ' H ' ' A' 3521 ' ' ALA . 13.4 mm100 -65.22 -39.94 93.44 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.628 178.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3592 ' ' THR . . . . . 0.431 ' O ' ' HG3' ' A' 3596 ' ' LYS . 31.6 m -61.85 -45.43 93.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.082 177.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -59.77 -50.09 75.18 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.921 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 61.3 m -61.08 -45.24 95.53 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.936 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.572 HD13 HD11 ' A' 3657 ' ' LEU . 44.8 tp -61.71 -45.33 94.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.072 -177.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.588 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 51.8 mtmt -57.95 -44.95 87.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.085 -179.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.88 -38.32 53.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.906 -175.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -89.69 -46.96 8.25 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -170.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.472 ' HB2' HD11 ' A' 3595 ' ' LEU . 22.9 m-85 -100.24 -50.84 3.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.721 0.296 . . . . 0.0 111.505 -175.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.588 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 32.4 mm -60.67 -58.91 5.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.841 -175.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 87.0 m -60.12 -42.57 95.06 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.363 -178.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 40.4 t80 -65.3 -53.59 41.72 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.044 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.517 HD11 ' N ' ' A' 3610 ' ' GLY . 0.3 OUTLIER -61.74 -37.15 83.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.568 0.223 . . . . 0.0 111.457 -176.599 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -76.73 -30.71 56.72 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -66.78 -36.24 81.94 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.164 0.506 . . . . 0.0 110.427 176.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -82.1 -18.49 42.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.589 178.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 50.05 54.52 10.94 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -168.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.475 ' O ' HD12 ' A' 3603 ' ' LEU . . . -136.05 -177.79 4.85 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.857 -172.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.731 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -116.67 120.2 37.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.959 176.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3610 ' ' GLY . . . . . 0.517 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.19 103.64 0.76 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 176.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.656 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 34.1 mm -89.36 117.84 33.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.239 0.542 . . . . 0.0 110.647 -174.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.605 HD12 ' HB3' ' A' 3547 ' ' LEU . 17.5 mt -113.74 117.2 54.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.225 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.5 ' HA ' ' O ' ' A' 3624 ' ' TYR . 10.0 m120 -92.38 117.42 29.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.758 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.448 HG22 ' HB2' ' A' 3537 ' ' SER . 31.5 m . . . . . 0 C--N 1.32 -0.712 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.249 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.5 ' O ' ' HA ' ' A' 3613 ' ' ASN . 38.5 m-85 . . . . . 0 CA--C 1.508 -0.644 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.465 HG12 HG22 ' A' 3611 ' ' ILE . 8.1 t -116.98 114.55 46.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.612 -177.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.615 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -97.86 112.72 24.53 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 169.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.511 ' HB2' ' HB ' ' A' 3660 ' ' VAL . 40.5 mt-30 -94.21 110.98 22.68 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.008 -176.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.586 HG12 HG12 ' A' 3659 ' ' ILE . 43.5 mt -91.99 98.33 8.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.341 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -89.23 137.51 29.26 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.767 177.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.31 171.14 9.65 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.755 2.304 . . . . 0.0 111.68 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.42 52.98 2.08 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.671 2.248 . . . . 0.0 112.438 177.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 17.8 p -85.42 162.24 19.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.53 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -48.66 -45.83 39.34 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.597 0.561 . . . . 0.0 111.111 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 16.7 t80 -48.94 -46.29 43.06 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.421 177.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 7.4 m -64.67 -53.97 39.05 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.833 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -64.42 -33.13 75.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.155 -175.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 38.4 m -63.38 -48.6 77.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.106 0.479 . . . . 0.0 110.455 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -68.46 -37.66 80.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.358 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 74.0 mt -62.43 -41.76 98.95 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.648 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 5.1 p -68.35 -30.87 69.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.022 0.439 . . . . 0.0 110.831 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -79.61 -38.62 33.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.122 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.598 HD12 HD22 ' A' 3575 ' ' LEU . 19.4 mt -86.39 -37.31 18.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -144.23 74.85 15.65 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -176.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.92 -21.33 57.32 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.517 2.144 . . . . 0.0 111.828 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3645 ' ' ASP . . . . . 0.576 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.6 m-20 -73.36 -44.66 58.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.488 -177.075 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.698 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -84.5 -31.21 24.61 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 177.742 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.648 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.2 tm? -53.78 -41.31 67.07 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.577 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -64.55 -18.14 64.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.875 -178.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 72.4 m -90.38 -34.32 15.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.824 0.345 . . . . 0.0 111.024 176.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.553 ' HA ' HG21 ' A' 3653 ' ' ILE . 5.8 pt -83.8 -13.36 11.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.688 -174.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 33.7 p -58.34 -28.5 65.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.059 0.457 . . . . 0.0 110.867 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 10.1 m120 -88.75 -33.09 17.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.074 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.553 HG21 ' HA ' ' A' 3650 ' ' ILE . 9.4 tp -105.19 37.54 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 122.218 1.008 . . . . 0.0 109.398 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.492 ' N ' ' HD2' ' A' 3655 ' ' PRO . 7.9 m -35.72 -43.59 0.77 Allowed Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 114.15 -1.386 . . . . 0.0 113.916 173.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' 3654 ' ' SER . 15.0 Cg_endo -59.24 81.59 0.05 OUTLIER 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.925 1.75 . . . . 0.0 112.213 170.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3656 ' ' HIS . . . . . 0.457 ' CB ' HD22 ' A' 3579 ' ' LEU . 34.3 p80 -155.18 179.7 8.9 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.734 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.572 HD11 HD13 ' A' 3595 ' ' LEU . 23.6 mt -122.75 147.86 46.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.768 -177.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.6 ttp -108.22 110.08 21.62 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 174.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.586 HG12 HG12 ' A' 3628 ' ' ILE . 78.2 mt -103.59 120.49 53.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.149 0.499 . . . . 0.0 111.597 -172.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.84 HG12 ' HD2' ' A' 3573 ' ' TYR . 95.6 t -105.6 115.94 48.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.995 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.615 HG12 ' HG ' ' A' 3626 ' ' LEU . 60.2 mt -90.61 112.4 24.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.6 127.85 56.22 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.985 0.422 . . . . 0.0 111.721 -175.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 22.3 m -81.24 114.39 20.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.108 170.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 52.0 t . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.326 -0.845 . . . . 0.0 109.97 -174.422 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.54 ' CD1' ' HB2' ' A' 3553 ' ' MET . 69.8 m-85 . . . . . 0 N--CA 1.48 1.037 0 CA-C-O 119.754 -0.165 . . . . 0.0 111.418 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.628 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 38.6 mt-10 53.56 -157.44 0.17 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.719 0.771 . . . . 0.0 111.348 177.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 33.3 m -144.81 114.09 7.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 166.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.597 HD11 ' HD2' ' A' 3552 ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -176.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.59 HD11 ' HB2' ' A' 3646 ' ' LEU . 2.7 pp . . . . . 0 CA--C 1.531 0.216 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.642 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.15 -15.84 63.01 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.467 -171.52 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.642 ' N ' HD12 ' A' 3502 ' ' LEU . 0.1 OUTLIER -72.17 -19.48 61.74 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3504 ' ' LYS . . . . . 0.653 ' HD2' ' N ' ' A' 3504 ' ' LYS . 0.0 OUTLIER -104.84 -42.38 5.37 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.073 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.724 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.5 103.04 3.48 Favored Pre-proline 0 N--CA 1.446 -0.631 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.214 178.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3506 ' ' PRO . . . . . 0.495 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 98.3 Cg_endo -84.99 174.96 6.95 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 124.369 3.38 . . . . 0.0 113.726 -177.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.528 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.1 mt -71.3 136.36 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.432 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3508 ' ' VAL . . . . . 0.401 HG12 ' HB2' ' A' 3526 ' ' PHE . 29.4 m -104.01 -22.85 4.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.344 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.595 ' CB ' HD11 ' A' 3538 ' ' LEU . 77.1 t-105 -157.73 150.23 22.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.734 -177.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -144.29 118.33 9.44 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.89 -129.53 1.09 Allowed Glycine 0 N--CA 1.441 -0.969 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 -177.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.595 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -141.64 151.46 43.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.186 0.517 . . . . 0.0 111.23 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.473 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.4 mt -105.2 148.79 26.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 169.443 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.666 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.55 124.95 13.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.691 0.281 . . . . 0.0 111.639 -177.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.821 HD13 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.56 142.42 41.34 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 173.839 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.821 ' CD ' HD13 ' A' 3515 ' ' LEU . 0.5 OUTLIER 60.38 -91.25 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.904 0.482 . . . . 0.0 109.98 -170.465 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -143.84 9.09 1.51 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -99.14 131.02 45.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.817 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 31.1 p -119.54 145.28 46.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.498 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -140.45 116.75 10.64 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.595 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.61 120.85 16.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.107 0.479 . . . . 0.0 110.078 177.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' 3579 ' ' LEU . 27.5 m -128.87 148.57 33.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.562 0.696 . . . . 0.0 111.852 -175.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -110.31 125.48 53.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.986 -1.006 . . . . 0.0 108.621 172.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.6 HD23 HD13 ' A' 3576 ' ' LEU . 0.9 OUTLIER -96.89 107.82 20.4 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.227 0.537 . . . . 0.0 111.676 -175.378 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.528 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 62.6 m-70 -85.07 138.25 32.54 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.134 175.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.724 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.1 t80 -66.71 137.76 56.91 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 174.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.636 ' CG1' HD21 ' A' 3575 ' ' LEU . 21.0 t -114.94 -58.11 3.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.407 0.622 . . . . 0.0 110.617 176.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.477 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 67.5 m -158.99 172.16 18.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.079 -170.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.13 -156.64 28.59 Favored Glycine 0 N--CA 1.453 -0.186 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.776 177.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.529 ' HB2' ' HA ' ' A' 3571 ' ' THR . 37.9 t30 -100.23 110.92 23.18 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 6.6 p30 -62.89 -26.15 68.64 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.463 -175.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3532 ' ' VAL . . . . . 0.541 ' O ' ' HG2' ' A' 3536 ' ' ARG . 80.2 t -58.4 -35.42 54.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-O 120.787 0.327 . . . . 0.0 110.418 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.529 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 40.1 mt -58.19 -42.45 86.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.031 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.451 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.09 -41.83 94.63 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.954 0.407 . . . . 0.0 110.432 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 22.8 t60 -58.7 -41.59 86.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.854 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3536 ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' 3532 ' ' VAL . 14.2 ptp180 -89.5 -9.84 48.49 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.52 ' HB2' HD13 ' A' 3626 ' ' LEU . 33.7 p -99.82 -34.32 10.2 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.126 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.595 HD11 ' CB ' ' A' 3509 ' ' TRP . 21.7 mt -81.33 104.62 3.08 Favored Pre-proline 0 C--N 1.32 -0.698 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3539 ' ' PRO . . . . . 0.422 ' HD3' ' O ' ' A' 3537 ' ' SER . 57.3 Cg_endo . . . . . 0 N--CA 1.461 -0.439 0 C-N-CA 123.223 2.615 . . . . 0.0 114.763 -165.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo . . . . . 0 N--CA 1.462 -0.37 0 CA-C-O 120.831 0.263 . . . . 0.0 111.963 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.589 ' HB3' HD11 ' A' 3612 ' ' ILE . 37.5 mt -81.58 115.73 21.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.912 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.666 ' HA ' ' O ' ' A' 3514 ' ' ALA . 29.1 ptt85 -90.45 140.46 29.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.2 -178.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.459 ' HA ' HG12 ' A' 3612 ' ' ILE . 17.6 mt -92.39 107.86 19.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 CA-C-O 121.944 0.878 . . . . 0.0 110.617 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.509 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.04 -3.17 14.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.064 -172.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.672 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 21.2 mt-30 -151.39 173.19 14.83 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.402 0.144 . . . . 0.0 111.127 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.679 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.42 139.65 17.54 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.847 0.356 . . . . 0.0 111.269 -179.658 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.575 ' O ' ' HA ' ' A' 3608 ' ' ALA . 16.5 ttt -109.17 142.67 39.64 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.101 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -77.66 110.94 12.93 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.628 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -76.86 97.76 4.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.109 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.608 ' HB2' ' HG2' ' A' 3559 ' ' GLN . 19.4 mm-40 -115.94 165.07 13.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.523 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.48 -54.6 38.8 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.176 0.297 . . . . 0.0 111.301 -178.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 27.0 p -62.48 -38.29 89.3 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 111.305 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.608 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 29.1 mm-40 -65.97 -46.86 76.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.995 -177.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' 3556 ' ' GLU . 92.0 mt -63.57 -32.01 73.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.084 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.6 mm-40 -65.34 -46.11 81.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.236 0.541 . . . . 0.0 109.952 175.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.17 99.64 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.099 176.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.532 ' O ' ' HG3' ' A' 3567 ' ' MET . 80.8 t -59.63 -45.67 94.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.903 0.382 . . . . 0.0 110.217 175.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.89 -30.04 68.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.737 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -62.35 -37.47 85.78 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -88.01 -7.79 56.56 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.646 176.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' 3563 ' ' VAL . 80.6 mtp -87.21 -24.25 24.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.619 177.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 31.0 p -81.87 -22.43 36.93 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.233 0.539 . . . . 0.0 110.275 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 39.7 t -93.26 80.41 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.644 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -67.21 109.2 2.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.01 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.529 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.0 m 151.77 -40.86 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.587 1.555 . . . . 0.0 108.016 -175.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -86.3 -17.51 34.41 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.689 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.762 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -136.2 163.12 31.11 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.028 0.442 . . . . 0.0 109.976 177.497 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.555 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 43.7 t -126.32 135.63 51.73 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 171.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.636 HD21 ' CG1' ' A' 3527 ' ' VAL . 14.8 tp -105.4 125.89 51.5 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.6 HD13 HD23 ' A' 3524 ' ' LEU . 73.5 mt -127.16 154.73 44.4 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.758 -177.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.779 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.4 OUTLIER -121.78 108.84 13.97 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.959 178.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.461 ' HB2' HD11 ' A' 3659 ' ' ILE . . . -94.75 123.16 38.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.384 0.611 . . . . 0.0 110.534 -178.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.433 ' HG ' HD12 ' A' 3577 ' ' LEU . 57.6 mt -125.28 145.57 51.19 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.205 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.22 116.02 2.98 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.415 2.077 . . . . 0.0 111.814 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.8 p -100.73 105.32 16.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.192 0.52 . . . . 0.0 110.842 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.13 145.79 16.15 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.36 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3583 ' ' ARG . . . . . 0.552 ' HG2' ' HB2' ' A' 3587 ' ' ASP . 9.0 ptp85 -61.44 -32.72 72.7 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.142 0.496 . . . . 0.0 110.993 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.572 ' O ' HG23 ' A' 3588 ' ' VAL . 2.8 p-10 -152.26 -179.45 7.55 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.799 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -49.52 -44.93 46.72 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.591 0.557 . . . . 0.0 111.479 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.93 -49.12 73.85 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 120.823 0.344 . . . . 0.0 110.773 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.552 ' HB2' ' HG2' ' A' 3583 ' ' ARG . 15.8 t0 -62.74 -42.92 99.9 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.968 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' 3584 ' ' ASP . 89.7 t -56.82 -49.35 79.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.674 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 70.9 t -62.19 -44.96 99.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.528 -179.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 32.6 t -61.06 -39.17 88.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.922 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3591 ' ' GLN . . . . . 0.461 ' HA ' ' OE1' ' A' 3591 ' ' GLN . 12.6 mm-40 -72.83 -35.59 67.31 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.576 178.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 63.9 m -61.01 -53.18 60.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.566 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3593 ' ' GLU . . . . . 0.517 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 11.1 pt-20 -63.17 -38.67 92.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.171 -178.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.1 m -65.88 -46.52 78.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 0.0 110.56 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.571 HD11 HD11 ' A' 3657 ' ' LEU . 62.1 tp -62.44 -45.89 91.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.264 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.838 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 62.7 pttt -70.1 -26.87 64.18 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.48 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.55 -39.47 20.35 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.929 0.395 . . . . 0.0 111.305 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -89.74 -46.07 8.86 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -172.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.486 ' HB2' HD13 ' A' 3595 ' ' LEU . 18.9 m-85 -99.37 -50.35 4.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.667 0.27 . . . . 0.0 111.619 -175.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.838 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.1 mm -62.15 -55.7 22.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 -176.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 90.4 m -58.04 -43.68 86.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.001 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.758 ' CE2' HD21 ' A' 3603 ' ' LEU . 0.1 OUTLIER -61.11 -56.93 15.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.895 -0.138 . . . . 0.0 110.782 177.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.758 HD21 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.7 -43.38 80.46 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -178.671 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -71.58 -38.63 70.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.774 0.321 . . . . 0.0 110.508 -176.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.72 67.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.942 0.401 . . . . 0.0 111.062 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3606 ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' A' 3602 ' ' TYR . 73.4 mmtt -83.18 -19.56 36.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.737 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3607 ' ' GLN . . . . . 0.581 ' O ' ' HG ' ' A' 3555 ' ' LEU . 28.0 mt-30 54.3 47.46 22.95 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -170.249 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.575 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -127.44 179.0 5.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.791 -171.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.679 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -117.7 118.16 31.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.02 171.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3610 ' ' GLY . . . . . 0.458 ' N ' HD12 ' A' 3603 ' ' LEU . . . -65.45 102.76 0.71 Allowed Glycine 0 C--O 1.221 -0.672 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.493 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.672 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 30.2 mm -88.88 119.89 36.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.229 0.537 . . . . 0.0 110.695 -175.155 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.589 HD11 ' HB3' ' A' 3547 ' ' LEU . 36.3 mt -114.86 106.53 20.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.165 176.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' A' 3624 ' ' TYR . 7.7 m120 -84.49 129.06 34.89 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.869 176.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.45 HG21 ' O ' ' A' 3537 ' ' SER . 3.3 p . . . . . 0 C--N 1.317 -0.843 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.656 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' A' 3613 ' ' ASN . 72.2 m-85 . . . . . 0 N--CA 1.45 -0.474 0 CA-C-O 120.95 0.405 . . . . 0.0 110.084 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.453 HG13 HG23 ' A' 3611 ' ' ILE . 11.5 t -120.56 113.46 40.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.003 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.646 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -96.3 110.97 23.19 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 170.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.466 ' HB2' ' HB ' ' A' 3660 ' ' VAL . 44.0 mt-30 -94.1 111.9 23.66 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.205 -177.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.573 HG12 HG12 ' A' 3659 ' ' ILE . 37.1 mt -92.05 97.83 7.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.099 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -89.71 135.92 30.06 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.761 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.548 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 37.3 Cg_endo -66.38 171.02 11.1 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.819 2.346 . . . . 0.0 111.698 177.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.27 42.4 0.38 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.129 2.553 . . . . 0.0 113.126 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.404 ' H ' ' C ' ' A' 3630 ' ' PRO . 24.1 p -75.37 161.78 28.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.425 177.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -53.18 -35.73 60.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.516 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 24.2 t80 -53.01 -48.73 67.31 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.888 0.375 . . . . 0.0 111.059 176.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 10.8 m -67.05 -52.52 41.24 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.39 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -57.17 -43.56 82.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.676 -176.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 23.3 m -65.65 -46.35 79.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.035 0.445 . . . . 0.0 110.613 -177.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 8.0 m80 -63.69 -38.5 91.35 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.696 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 69.3 mt -65.76 -40.83 92.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.809 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.627 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 11.6 p -68.59 -27.09 65.74 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.841 -0.343 . . . . 0.0 110.822 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.3 -47.11 13.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 176.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.577 HD11 HD22 ' A' 3575 ' ' LEU . 20.8 mt -77.04 -40.95 44.46 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.394 -173.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.517 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -143.09 86.7 9.06 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-O 120.756 0.313 . . . . 0.0 111.216 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.37 -23.07 28.44 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.662 2.241 . . . . 0.0 113.475 -174.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 20.0 t0 -78.37 -49.41 13.61 Favored 'General case' 0 CA--C 1.516 -0.335 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.241 -174.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.779 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -72.3 -30.48 64.83 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.135 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.627 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -55.78 -45.89 78.06 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.131 177.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.06 -27.69 68.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.035 0.445 . . . . 0.0 111.206 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 6.9 m -79.28 -39.3 33.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.705 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.557 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.6 pt -80.79 -11.72 12.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 120.903 0.382 . . . . 0.0 111.522 -174.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 45.5 m -57.94 -26.98 62.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.447 175.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -87.06 -34.74 19.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.368 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.557 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.1 tp -104.35 40.19 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-O 122.292 1.044 . . . . 0.0 109.635 -179.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.44 ' N ' ' HD2' ' A' 3655 ' ' PRO . 49.3 m -33.38 -44.66 0.46 Allowed Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 114.113 -1.403 . . . . 0.0 113.829 169.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.474 ' HG2' HD12 ' A' 3653 ' ' ILE . 13.5 Cg_endo -59.53 76.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 121.707 1.605 . . . . 0.0 111.819 169.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3656 ' ' HIS . . . . . 0.422 ' HB2' HD22 ' A' 3579 ' ' LEU . 18.5 p80 -146.22 174.06 11.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.781 -176.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.571 HD11 HD11 ' A' 3595 ' ' LEU . 36.5 mt -123.33 144.96 49.11 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.482 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 55.6 ttp -107.17 110.46 22.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.573 HG12 HG12 ' A' 3628 ' ' ILE . 88.9 mt -101.52 115.75 43.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.433 0.635 . . . . 0.0 111.32 -173.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.762 HG13 ' HD2' ' A' 3573 ' ' TYR . 90.8 t -102.75 112.03 34.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.615 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.646 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.7 mt -90.38 112.57 25.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.102 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -112.18 127.46 55.95 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.843 0.354 . . . . 0.0 110.953 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 15.1 p -94.62 109.63 21.53 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 172.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--O 1.249 1.073 0 CA-C-O 117.894 -1.051 . . . . 0.0 111.256 -175.916 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.475 ' CD1' ' HB2' ' A' 3553 ' ' MET . 46.7 m-85 . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.553 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.4 OUTLIER 55.37 -156.65 0.25 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.802 0.81 . . . . 0.0 111.879 174.495 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B 2520 ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' 3551 ' ' GLN . 4.2 t -153.45 127.01 8.69 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.321 -1.309 . . . . 0.0 107.682 167.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.517 ' HG ' ' OH ' ' A' 3602 ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.39 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.6 HD11 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -71.2 -15.71 62.48 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.177 -174.786 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.6 ' N ' HD11 ' A' 3502 ' ' LEU . 52.3 tptt -71.04 -18.31 62.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.494 0.664 . . . . 0.0 109.46 177.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3504 ' ' LYS . . . . . 0.422 ' HB3' ' CE2' ' A' 3505 ' ' TYR . 29.2 mmtp -104.91 -44.65 4.77 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.92 174.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.688 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -151.87 105.6 2.85 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.553 -177.671 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 3506 ' ' PRO . . . . . 0.548 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 88.7 Cg_endo -83.69 173.73 9.19 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.952 3.101 . . . . 0.0 113.655 -175.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.588 HG12 ' CD2' ' A' 3525 ' ' HIS . 61.3 mt -71.56 132.03 33.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.524 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3508 ' ' VAL . . . . . 0.445 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.3 m -100.38 -31.34 3.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.587 -178.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.546 ' CB ' HD12 ' A' 3538 ' ' LEU . 51.4 t-105 -148.59 155.13 40.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 110.521 -177.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -149.02 120.04 7.69 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 176.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -169.58 -127.34 0.92 Allowed Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.623 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.2 mp -141.37 153.91 45.35 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.005 0.431 . . . . 0.0 110.82 178.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.463 HD21 ' HB2' ' A' 3547 ' ' LEU . 98.2 mt -107.78 150.83 26.51 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 169.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.738 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -147.83 124.5 11.13 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.779 0.323 . . . . 0.0 111.608 -178.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.676 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -136.41 139.58 42.55 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 174.256 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.676 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.0 OUTLIER 62.49 -95.26 0.05 OUTLIER 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 -167.634 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 14.0 m120 -140.16 6.6 2.16 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.188 176.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.494 ' O ' ' HA ' ' A' 3514 ' ' ALA . 11.9 m-20 -91.22 127.86 36.82 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.366 -174.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.469 HG22 ' HB1' ' A' 3514 ' ' ALA . 40.4 p -119.89 145.3 46.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.936 0.398 . . . . 0.0 111.627 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -142.87 120.16 11.56 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 174.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.617 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.93 118.6 16.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.964 0.412 . . . . 0.0 109.937 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.433 ' HA ' ' O ' ' A' 3579 ' ' LEU . 33.5 m -126.55 147.59 31.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.725 0.774 . . . . 0.0 112.525 -174.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -106.24 125.31 50.83 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.614 171.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.59 HD23 HD13 ' A' 3576 ' ' LEU . 0.9 OUTLIER -96.16 106.43 18.62 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.42 0.629 . . . . 0.0 111.176 -177.875 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.588 ' CD2' HG12 ' A' 3507 ' ' ILE . 29.1 m170 -82.96 138.79 33.67 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.407 176.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.688 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.8 t80 -68.93 137.28 53.68 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 174.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.625 ' CG1' HD21 ' A' 3575 ' ' LEU . 21.3 t -114.66 -56.52 4.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.447 0.641 . . . . 0.0 110.871 177.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.411 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 37.6 m -162.87 171.88 15.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.091 -171.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.61 -155.12 26.59 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.348 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3530 ' ' ASN . . . . . . . . . . . . . 39.2 t30 -100.18 113.82 26.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.619 0.247 . . . . 0.0 110.77 -178.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -64.12 -27.84 69.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.461 -177.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 49.4 t -60.33 -33.09 52.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.865 0.364 . . . . 0.0 110.362 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.447 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 23.0 mt -60.15 -39.76 87.49 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.968 178.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.442 ' HA ' HD11 ' A' 3661 ' ' ILE . . . -67.54 -41.36 84.41 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.542 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 32.3 t60 -64.33 -35.0 79.45 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.895 0.379 . . . . 0.0 110.723 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3536 ' ' ARG . . . . . 0.414 ' HD3' HD23 ' A' 3533 ' ' LEU . 13.3 ptm180 -89.25 -8.99 52.36 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -177.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.466 ' O ' HG21 ' A' 3614 ' ' VAL . 34.0 p -104.87 -39.89 6.13 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.557 177.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.546 HD12 ' CB ' ' A' 3509 ' ' TRP . 26.0 mt -80.69 109.34 12.75 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.039 0.447 . . . . 0.0 109.911 -174.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3539 ' ' PRO . . . . . 0.433 ' HD3' HG21 ' A' 3614 ' ' VAL . 61.1 Cg_endo . . . . . 0 N--CA 1.457 -0.647 0 C-N-CA 122.995 2.464 . . . . 0.0 113.057 -172.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3546 ' ' PRO . . . . . 0.623 ' HA ' ' O ' ' A' 3512 ' ' LEU . 74.0 Cg_endo . . . . . 0 N--CA 1.457 -0.628 0 CA-C-O 121.043 0.351 . . . . 0.0 112.632 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.621 ' HB3' HD12 ' A' 3612 ' ' ILE . 55.3 mt -69.18 120.07 14.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.033 176.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.738 ' HA ' ' O ' ' A' 3514 ' ' ALA . 14.3 ptt180 -93.7 141.14 28.82 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.838 0.351 . . . . 0.0 111.285 -176.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.488 ' CG2' HD23 ' B' 2521 ' ' LEU . 25.2 mt -99.03 106.19 18.52 Favored 'Isoleucine or valine' 0 C--O 1.245 0.84 0 CA-C-O 121.922 0.867 . . . . 0.0 111.075 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.431 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.03 0.06 14.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.607 -174.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.622 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 23.1 mt-30 -148.55 175.31 11.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.514 178.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.79 ' HD3' ' HB2' ' B' 2521 ' ' LEU . 0.0 OUTLIER -159.85 140.11 11.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 111.752 -177.182 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.572 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -110.86 120.46 42.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.226 177.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.8 mmt180 -68.44 109.52 3.73 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.511 HD11 ' O ' ' A' 3555 ' ' LEU . 2.4 pp -71.56 98.3 1.85 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 122.209 1.004 . . . . 0.0 109.623 -177.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.507 ' O ' ' HG ' ' A' 3560 ' ' LEU . 36.3 mt-10 -108.87 164.72 12.14 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.026 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.617 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.16 -50.46 66.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.015 0.436 . . . . 0.0 110.214 179.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 3.0 p -60.5 -40.76 92.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.617 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.518 ' O ' HG22 ' A' 3563 ' ' VAL . 15.2 mm-40 -63.36 -50.1 71.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.697 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' 3556 ' ' GLU . 85.0 mt -61.13 -31.88 71.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.297 -176.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.617 ' HG2' ' O ' ' A' 3557 ' ' ALA . 18.3 mm-40 -60.74 -50.85 71.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.226 0.536 . . . . 0.0 109.754 174.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3562 ' ' GLY . . . . . 0.412 ' HA2' ' HD2' ' A' 3565 ' ' ARG . . . -63.87 -39.64 97.56 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.168 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.555 ' O ' ' HG3' ' A' 3567 ' ' MET . 90.4 t -60.24 -48.54 87.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.59 0.234 . . . . 0.0 110.782 177.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.66 -30.35 68.68 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.574 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.515 ' HG3' ' O ' ' A' 3561 ' ' GLU . 99.7 mtt180 -57.64 -42.36 83.27 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.528 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -87.06 -13.59 43.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.949 0.404 . . . . 0.0 110.604 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.555 ' HG3' ' O ' ' A' 3563 ' ' VAL . 85.6 mtp -79.53 -26.54 41.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.988 0.423 . . . . 0.0 110.593 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 15.1 t -85.0 1.37 47.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.188 0.518 . . . . 0.0 110.065 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 40.9 t -116.7 84.32 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.489 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.785 176.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -72.8 108.49 5.79 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3571 ' ' THR . . . . . . . . . . . . . 1.5 m 155.38 -43.52 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 O-C-N 124.998 1.436 . . . . 0.0 108.059 -173.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -86.65 -27.29 23.88 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.968 -177.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.76 ' HD2' HG11 ' A' 3660 ' ' VAL . 0.1 OUTLIER -129.41 162.08 28.87 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.939 178.215 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.585 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 48.8 t -124.41 136.91 54.43 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 170.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.625 HD21 ' CG1' ' A' 3527 ' ' VAL . 14.6 tp -105.85 125.44 50.99 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.59 HD13 HD23 ' A' 3524 ' ' LEU . 82.3 mt -127.11 153.21 46.3 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.111 0.481 . . . . 0.0 110.725 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.639 ' HG ' HD13 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.44 107.15 12.54 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.15 -179.538 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.459 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 124.01 38.16 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.416 0.627 . . . . 0.0 110.473 -177.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.458 HD21 ' HB2' ' A' 3656 ' ' HIS . 84.8 mt -125.42 146.31 53.97 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.155 -178.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.32 117.04 3.72 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.195 1.93 . . . . 0.0 111.88 176.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.2 p -107.21 106.7 17.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.286 0.565 . . . . 0.0 110.579 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.61 147.13 16.62 Favored Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.265 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -59.01 -35.03 72.56 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.254 0.55 . . . . 0.0 111.115 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.55 ' O ' HG21 ' A' 3588 ' ' VAL . 10.3 t70 -142.84 174.19 10.88 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -55.93 -33.86 65.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 118.613 0.642 . . . . 0.0 109.916 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3586 ' ' GLU . . . . . 0.406 ' H ' ' HG3' ' A' 3586 ' ' GLU . 20.1 mt-10 -56.49 -54.68 42.93 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.379 175.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' 3591 ' ' GLN . 3.1 t70 -65.84 -36.04 82.35 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.718 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.55 HG21 ' O ' ' A' 3584 ' ' ASP . 99.2 t -57.49 -48.03 83.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.299 178.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 65.9 t -60.19 -44.06 94.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.02 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 43.7 t -60.7 -46.59 89.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.153 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3591 ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' 3587 ' ' ASP . 70.9 mm-40 -65.15 -41.48 94.69 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 178.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 59.5 m -59.63 -53.28 59.83 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.959 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.39 -36.97 85.89 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.08 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 46.1 m -67.37 -44.52 78.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.883 0.373 . . . . 0.0 110.398 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.564 HD13 HD12 ' A' 3657 ' ' LEU . 46.5 tp -65.11 -46.4 81.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.983 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.765 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.93 -31.06 71.77 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.084 -176.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.09 -42.26 17.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.674 0.274 . . . . 0.0 111.363 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.414 ' HB2' ' HB3' ' A' 3518 ' ' ASP . . . -88.16 -45.67 9.92 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -170.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.498 ' HB2' HD11 ' A' 3595 ' ' LEU . 14.3 m-85 -99.48 -50.27 4.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.766 0.317 . . . . 0.0 111.245 -176.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.765 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 26.0 mm -61.56 -60.04 3.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.217 -175.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 88.8 m -59.08 -32.09 69.47 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 123.185 0.303 . . . . 0.0 111.238 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 42.1 t80 -77.09 -57.04 4.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.569 -177.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' 3608 ' ' ALA . 0.4 OUTLIER -55.97 -38.62 70.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.235 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.39 -32.82 64.68 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.859 -0.337 . . . . 0.0 110.168 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.48 93.54 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.209 0.528 . . . . 0.0 110.689 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -81.38 -16.82 51.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.057 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3607 ' ' GLN . . . . . 0.417 ' O ' ' HG ' ' A' 3555 ' ' LEU . 55.1 mt-30 53.22 49.58 19.59 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -169.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.528 ' O ' HD13 ' A' 3603 ' ' LEU . . . -131.12 -178.78 4.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.334 0.588 . . . . 0.0 112.373 -171.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.742 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.81 118.35 30.59 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.572 176.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3610 ' ' GLY . . . . . 0.444 ' N ' HD12 ' A' 3603 ' ' LEU . . . -63.61 104.84 0.92 Allowed Glycine 0 C--O 1.222 -0.594 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.562 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.622 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.4 mm -89.6 121.67 40.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.207 0.527 . . . . 0.0 111.066 -175.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.621 HD12 ' HB3' ' A' 3547 ' ' LEU . 19.3 mt -117.07 113.01 41.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.024 177.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.44 ' HA ' ' O ' ' A' 3624 ' ' TYR . 38.1 m-80 -92.09 108.01 19.63 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.445 -179.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.466 HG21 ' O ' ' A' 3537 ' ' SER . 7.2 p . . . . . 0 C--N 1.316 -0.864 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.635 -171.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.44 ' O ' ' HA ' ' A' 3613 ' ' ASN . 82.7 m-85 . . . . . 0 CA--C 1.513 -0.458 0 CA-C-O 120.891 0.377 . . . . 0.0 110.726 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.429 HG13 HD13 ' A' 3611 ' ' ILE . 4.4 t -118.76 113.92 43.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.287 178.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.605 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.9 mp -97.83 115.53 28.24 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 169.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.545 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 44.0 mt-30 -94.72 111.44 23.22 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.702 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.594 HG12 HG12 ' A' 3659 ' ' ILE . 38.7 mt -90.16 98.59 8.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.254 178.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -86.83 139.72 33.05 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.096 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.405 ' C ' ' H ' ' A' 3632 ' ' CYS . 44.1 Cg_endo -67.94 172.81 10.19 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.695 2.263 . . . . 0.0 111.52 176.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.21 43.59 0.5 Allowed 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 122.892 2.395 . . . . 0.0 112.58 176.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.405 ' H ' ' C ' ' A' 3630 ' ' PRO . 24.5 p -74.82 162.84 28.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.767 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -52.25 -40.75 62.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.202 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 31.3 t80 -50.43 -44.65 55.42 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.122 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.5 m -67.54 -56.92 7.58 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.655 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -57.11 -41.42 78.93 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.323 -0.399 . . . . 0.0 112.056 -175.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 12.0 p -66.83 -47.23 72.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.913 0.387 . . . . 0.0 110.869 -177.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 22.4 m-70 -66.9 -36.99 83.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.508 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 77.5 mt -61.89 -35.85 79.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.72 0.295 . . . . 0.0 110.819 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.874 ' HA ' HD21 ' A' 3647 ' ' LEU . 38.2 t -63.4 -37.77 88.58 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.182 0.515 . . . . 0.0 110.491 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3641 ' ' ARG . . . . . 0.611 ' NE ' ' HA ' ' A' 3641 ' ' ARG . 1.7 mmp_? -80.44 -32.23 37.34 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.011 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.588 HD11 HD23 ' A' 3575 ' ' LEU . 32.8 mt -96.63 -27.15 14.94 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -171.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.416 ' CB ' HG11 ' A' 3527 ' ' VAL . . . -159.32 79.69 2.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -178.081 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3644 ' ' PRO . . . . . 0.435 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 3.0 Cg_exo -73.75 -18.75 21.83 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.635 2.224 . . . . 0.0 111.546 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3645 ' ' ASP . . . . . 0.492 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 6.9 m-20 -69.52 -49.91 50.05 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.123 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.639 HD13 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -82.71 -25.01 33.35 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.278 179.147 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.874 HD21 ' HA ' ' A' 3640 ' ' SER . 34.8 tp -52.6 -49.69 64.53 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.581 178.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.52 -18.47 59.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.009 0.433 . . . . 0.0 111.632 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 15.5 m -87.33 -38.26 16.39 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.59 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.532 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.0 pt -78.72 -21.76 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -175.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 47.2 m -52.39 -30.31 28.4 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 120.765 0.317 . . . . 0.0 111.326 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -82.96 -42.86 17.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.951 0.405 . . . . 0.0 109.954 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.532 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.6 tp -96.88 39.07 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-O 122.76 1.267 . . . . 0.0 109.168 -178.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.485 ' N ' ' HD2' ' A' 3655 ' ' PRO . 4.3 p -40.41 -37.26 0.84 Allowed Pre-proline 0 CA--C 1.545 0.766 0 CA-C-N 113.449 -1.705 . . . . 0.0 114.961 174.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.485 ' HD2' ' N ' ' A' 3654 ' ' SER . 22.9 Cg_endo -63.89 74.07 0.17 Allowed 'Trans proline' 0 C--N 1.358 1.038 0 CA-C-N 121.053 1.412 . . . . 0.0 111.529 170.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3656 ' ' HIS . . . . . 0.458 ' HB2' HD21 ' A' 3579 ' ' LEU . 18.1 p80 -139.36 173.78 11.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.323 -175.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.564 HD12 HD13 ' A' 3595 ' ' LEU . 32.3 mt -121.69 148.46 44.57 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.33 178.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.3 ttp -111.21 107.89 17.36 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 174.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.594 HG12 HG12 ' A' 3628 ' ' ILE . 74.9 mt -100.91 117.26 45.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.285 0.564 . . . . 0.0 111.524 -171.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.76 HG11 ' HD2' ' A' 3573 ' ' TYR . 56.5 t -101.76 115.93 44.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.147 -178.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.605 HG12 ' HG ' ' A' 3626 ' ' LEU . 68.0 mt -90.34 113.12 25.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 177.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -108.94 127.34 53.98 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.914 0.388 . . . . 0.0 110.851 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 32.0 t -93.47 136.4 33.78 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.69 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 5.1 m . . . . . 0 C--O 1.246 0.907 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.453 179.739 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.572 ' CD1' ' HB2' ' A' 3553 ' ' MET . 11.8 m-85 . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.606 ' HG2' ' H ' ' B' 2520 ' ' THR . 35.6 tt0 57.85 -163.34 0.2 Allowed 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 174.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B 2520 ' ' THR . . . . . 0.606 ' H ' ' HG2' ' B' 2519 ' ' GLU . 41.3 m -150.56 124.23 9.13 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.79 ' HB2' ' HD3' ' A' 3552 ' ' ARG . 7.1 tp . . . . . 0 C--N 1.33 -0.276 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.463 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.658 HD11 ' HD1' ' A' 3525 ' ' HIS . 2.0 pp . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.642 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.48 -16.96 64.5 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.677 0.671 . . . . 0.0 110.278 -175.327 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.642 ' N ' HD12 ' A' 3502 ' ' LEU . 56.0 tptt -66.42 -25.8 66.92 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 121.358 0.599 . . . . 0.0 109.385 177.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -105.58 -42.23 5.26 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.992 177.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.632 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.19 105.64 3.16 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 121.503 0.668 . . . . 0.0 111.521 -177.657 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -82.86 175.34 8.74 Favored 'Trans proline' 0 CA--C 1.533 0.43 0 C-N-CA 124.24 3.293 . . . . 0.0 113.248 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.479 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 90.9 mt -70.78 132.85 32.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.136 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3508 ' ' VAL . . . . . 0.498 HG12 ' HB2' ' A' 3526 ' ' PHE . 29.2 m -100.76 -26.39 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.189 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.529 ' HB2' HD11 ' A' 3538 ' ' LEU . 43.2 t-105 -154.89 156.37 36.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.882 0.372 . . . . 0.0 110.779 -178.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3510 ' ' GLN . . . . . 0.455 HE21 ' HB3' ' A' 3510 ' ' GLN . 0.9 OUTLIER -151.29 119.22 6.21 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.74 -131.05 1.29 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.485 -0.646 . . . . 0.0 111.485 -176.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.61 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -140.55 150.38 43.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.217 0.532 . . . . 0.0 111.569 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.445 HD22 ' HB2' ' A' 3547 ' ' LEU . 83.1 mt -105.55 154.02 20.96 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 170.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -148.72 126.53 11.86 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.491 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.716 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.68 140.62 38.88 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 172.549 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.716 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.4 OUTLIER 62.52 -93.0 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -169.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 8.8 m120 -143.36 11.34 1.71 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 171.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.523 ' HB3' ' HB1' ' A' 3598 ' ' ALA . 27.9 m-20 -88.03 116.98 26.59 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.152 -176.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 21.8 p -110.54 133.42 53.31 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.91 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3520 ' ' ALA . . . . . 0.983 ' HB1' HE22 ' A' 3591 ' ' GLN . . . -135.11 120.1 18.63 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.379 177.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.61 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.93 117.76 16.09 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.209 0.528 . . . . 0.0 110.493 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.424 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 28.9 m -127.95 147.48 32.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.725 0.774 . . . . 0.0 112.126 -175.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -105.71 125.81 51.42 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.937 173.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.547 HD23 HD13 ' A' 3576 ' ' LEU . 2.0 mt -97.06 105.96 18.21 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.498 0.666 . . . . 0.0 111.573 -176.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.658 ' HD1' HD11 ' A' 3501 ' ' LEU . 26.0 m-70 -86.26 138.9 31.5 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.922 -1.035 . . . . 0.0 108.695 176.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.632 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.7 t80 -68.57 139.32 55.56 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.617 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.8 t -114.83 -55.67 4.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-O 121.298 0.57 . . . . 0.0 110.994 177.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 58.5 m -163.75 170.76 16.5 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.276 -172.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.87 -150.96 22.66 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.483 174.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.585 ' HB2' ' HA ' ' A' 3571 ' ' THR . 53.8 t-20 -93.45 107.74 19.53 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.342 -0.429 . . . . 0.0 110.553 -175.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -64.06 -30.82 71.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.634 0.254 . . . . 0.0 110.947 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 45.0 t -64.22 -31.57 53.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.955 0.407 . . . . 0.0 110.007 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' 3530 ' ' ASN . 16.6 mt -59.39 -40.2 85.81 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.774 176.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.35 87.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.909 0.385 . . . . 0.0 110.267 179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -61.35 -40.18 93.33 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -89.43 -10.13 47.62 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -176.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.639 ' O ' HG12 ' A' 3614 ' ' VAL . 77.5 p -103.87 -37.15 7.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.932 0.396 . . . . 0.0 111.416 -179.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.529 HD11 ' HB2' ' A' 3509 ' ' TRP . 21.1 mt -81.85 111.35 25.82 Favored Pre-proline 0 C--N 1.318 -0.783 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo . . . . . 0 N--CA 1.458 -0.584 0 C-N-CA 122.439 2.093 . . . . 0.0 112.985 -174.187 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A 3546 ' ' PRO . . . . . 0.413 ' HA ' ' O ' ' A' 3512 ' ' LEU . 22.0 Cg_endo . . . . . 0 N--CA 1.462 -0.366 0 CA-C-O 121.051 0.355 . . . . 0.0 112.428 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.542 ' HB3' HD13 ' A' 3612 ' ' ILE . 65.4 mt -69.29 109.51 4.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.175 178.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.1 OUTLIER -90.51 134.82 34.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.879 0.371 . . . . 0.0 110.513 -177.784 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.462 HG12 HD12 ' A' 3612 ' ' ILE . 16.9 mt -90.52 107.29 18.3 Favored 'Isoleucine or valine' 0 C--O 1.248 0.997 0 CA-C-O 122.401 1.096 . . . . 0.0 111.061 -177.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.565 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -119.81 10.61 11.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.425 -174.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.776 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 32.1 mt-30 -154.49 167.68 29.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.832 -0.167 . . . . 0.0 110.558 179.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.706 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.41 143.27 14.85 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.869 0.366 . . . . 0.0 111.785 -177.221 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.545 ' O ' ' HA ' ' A' 3608 ' ' ALA . 12.4 tmm? -119.09 134.72 55.03 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.304 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -70.81 109.67 5.13 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.61 HD11 ' O ' ' A' 3555 ' ' LEU . 2.6 pp -74.57 98.23 3.33 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.115 0.96 . . . . 0.0 109.801 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3556 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -116.36 172.15 7.38 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.296 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.62 68.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.693 0.282 . . . . 0.0 111.268 -176.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 60.1 p -71.11 -37.22 72.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.162 -178.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.483 ' HA ' ' OE1' ' A' 3559 ' ' GLN . 11.7 mm-40 -63.69 -49.51 72.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.536 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3560 ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.09 -35.79 79.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.029 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -66.65 -44.16 82.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.053 0.454 . . . . 0.0 110.586 174.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -52.53 -42.12 57.27 Favored Glycine 0 CA--C 1.518 0.254 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.993 173.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.523 ' O ' ' HG3' ' A' 3567 ' ' MET . 42.7 t -65.82 -49.6 76.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 174.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3564 ' ' ALA . . . . . 0.552 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.08 -27.2 63.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.817 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.536 ' O ' HG21 ' A' 3568 ' ' THR . 0.0 OUTLIER -58.57 -45.57 88.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.88 177.443 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -87.79 -4.44 58.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.074 0.464 . . . . 0.0 110.711 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.552 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 87.6 mtp -85.94 -15.88 40.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.141 178.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3568 ' ' THR . . . . . 0.536 HG21 ' O ' ' A' 3565 ' ' ARG . 11.6 t -85.95 3.13 43.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.11 0.481 . . . . 0.0 110.32 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 20.6 t -117.48 89.61 1.39 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.473 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.14 110.31 3.93 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.585 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.5 m 142.24 -42.97 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.774 1.629 . . . . 0.0 108.279 -177.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.24 -31.16 43.5 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.092 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.676 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -129.85 167.44 18.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.36 -0.382 . . . . 0.0 109.988 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.607 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 49.8 t -128.16 137.15 51.95 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.618 HD21 HD13 ' A' 3642 ' ' LEU . 14.1 tp -106.98 125.97 51.7 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 178.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.547 HD13 HD23 ' A' 3524 ' ' LEU . 75.6 mt -127.41 152.42 47.54 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.04 0.448 . . . . 0.0 110.911 -177.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.639 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.35 107.55 13.07 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.457 ' HB1' HD13 ' A' 3659 ' ' ILE . . . -94.66 119.2 32.93 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.376 0.608 . . . . 0.0 110.339 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.443 ' HG ' HD12 ' A' 3577 ' ' LEU . 48.2 mt -117.19 147.92 41.37 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.251 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3580 ' ' PRO . . . . . 0.434 ' HG2' HD13 ' A' 3653 ' ' ILE . 19.3 Cg_endo -60.45 123.06 12.3 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.234 1.956 . . . . 0.0 111.932 175.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.8 p -117.0 116.53 27.55 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.465 0.65 . . . . 0.0 110.887 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.66 146.77 16.5 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.948 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -62.78 -36.22 82.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.594 0.711 . . . . 0.0 109.226 178.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.576 ' O ' HG22 ' A' 3588 ' ' VAL . 16.9 t70 -131.23 166.17 21.75 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -55.85 -39.12 70.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.833 0.349 . . . . 0.0 110.648 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -66.42 -42.5 87.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.998 0.427 . . . . 0.0 110.37 177.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.4 ' HB3' ' H ' ' A' 3584 ' ' ASP . 24.1 t70 -61.42 -38.52 87.44 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.152 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.576 HG22 ' O ' ' A' 3584 ' ' ASP . 78.9 t -56.33 -47.41 81.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.44 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 83.0 t -59.42 -47.43 90.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.324 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 36.1 t -60.65 -45.5 93.86 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.162 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3591 ' ' GLN . . . . . 0.983 HE22 ' HB1' ' A' 3520 ' ' ALA . 25.9 tp60 -67.56 -41.58 83.98 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.826 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3592 ' ' THR . . . . . 0.513 ' O ' ' HG3' ' A' 3596 ' ' LYS . 87.7 m -57.6 -52.37 65.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.516 0.198 . . . . 0.0 110.991 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3593 ' ' GLU . . . . . 0.515 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 12.2 pt-20 -65.13 -31.13 72.16 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.759 0.314 . . . . 0.0 111.32 -178.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 48.9 m -68.71 -48.62 63.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.848 0.356 . . . . 0.0 110.38 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.551 HD12 HD12 ' A' 3657 ' ' LEU . 55.9 tp -62.19 -41.89 98.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.843 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.529 ' O ' ' HB ' ' A' 3600 ' ' ILE . 53.4 mtmt -57.77 -48.16 80.46 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.008 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -75.85 -39.57 56.33 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.523 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -86.97 -46.77 9.54 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -169.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.549 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 17.4 m-85 -99.51 -50.45 4.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.818 0.342 . . . . 0.0 111.283 -177.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.529 ' HB ' ' O ' ' A' 3596 ' ' LYS . 31.1 mm -61.07 -55.84 21.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.69 -175.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 48.0 m -60.48 -45.94 91.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.248 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.72 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.0 OUTLIER -60.14 -52.28 66.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.724 0.297 . . . . 0.0 110.648 179.193 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.72 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -67.78 -34.1 76.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.785 0.326 . . . . 0.0 110.833 -170.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -76.62 -38.89 53.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.139 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.94 -41.12 78.49 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 120.804 0.335 . . . . 0.0 110.936 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -78.32 -10.45 59.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.395 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3607 ' ' GLN . . . . . 0.411 ' O ' ' HG ' ' A' 3555 ' ' LEU . 43.0 mt-30 55.17 47.93 20.64 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.334 0.396 . . . . 0.0 111.017 178.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.545 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -133.88 171.43 14.19 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -171.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.706 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -104.4 117.82 35.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.213 170.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -67.78 104.37 1.15 Allowed Glycine 0 C--O 1.222 -0.598 0 C-N-CA 120.636 -0.793 . . . . 0.0 111.702 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.776 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 31.9 mm -90.38 131.24 38.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.073 0.463 . . . . 0.0 111.14 -174.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.542 HD13 ' HB3' ' A' 3547 ' ' LEU . 55.3 mt -131.46 108.83 15.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.039 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.68 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.0 m120 -81.06 136.47 35.96 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.25 0.547 . . . . 0.0 111.033 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.639 HG12 ' O ' ' A' 3537 ' ' SER . 21.3 t . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.807 -177.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.68 ' O ' ' HA ' ' A' 3613 ' ' ASN . 62.0 m-85 . . . . . 0 CA--C 1.509 -0.621 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.44 HG13 HG21 ' A' 3611 ' ' ILE . 3.8 t -125.2 113.71 36.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.003 177.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.615 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -96.74 112.19 24.05 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 169.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3627 ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -94.51 110.57 22.36 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -178.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.579 HG12 HG12 ' A' 3659 ' ' ILE . 32.9 mt -90.98 99.26 9.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.993 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -89.83 138.44 27.88 Favored Pre-proline 0 C--N 1.318 -0.778 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.12 178.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.573 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 36.4 Cg_endo -65.53 169.57 12.49 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.556 2.171 . . . . 0.0 111.113 175.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.0 53.45 1.53 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 122.703 2.269 . . . . 0.0 112.51 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 26.0 p -81.03 162.63 23.71 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.429 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -52.2 -41.06 62.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.542 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 26.4 t80 -57.46 -44.73 85.03 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 14.6 m -61.58 -58.47 7.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.77 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -60.16 -37.87 81.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.465 -174.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 39.6 m -66.81 -49.97 64.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.838 0.352 . . . . 0.0 110.74 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -65.38 -32.63 74.37 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.554 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 50.8 mt -63.5 -35.19 79.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.365 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.637 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 19.3 t -72.04 -33.33 67.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.049 0.452 . . . . 0.0 110.148 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -78.97 -30.65 44.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.02 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.618 HD13 HD21 ' A' 3575 ' ' LEU . 22.4 mt -93.49 -38.84 11.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.893 -177.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.472 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -144.64 74.93 14.94 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -176.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.58 -17.8 53.38 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 122.485 2.123 . . . . 0.0 112.324 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3645 ' ' ASP . . . . . 0.597 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.3 m-20 -72.66 -50.01 27.89 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.338 -177.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.639 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -82.56 -27.04 31.85 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 178.38 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.637 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -53.49 -42.99 67.85 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.156 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -65.18 -17.97 64.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.635 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 15.0 m -89.75 -34.19 16.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.923 0.392 . . . . 0.0 110.72 177.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.549 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.4 pt -85.52 -13.37 11.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -174.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 12.0 p -56.72 -31.31 64.4 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.192 0.52 . . . . 0.0 110.464 175.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 9.4 t30 -83.31 -36.74 24.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.673 174.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.549 HG22 ' HA ' ' A' 3650 ' ' ILE . 20.8 tt -104.59 45.17 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 122.741 1.258 . . . . 0.0 110.103 -177.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.462 ' N ' ' HD2' ' A' 3655 ' ' PRO . 19.9 m -33.7 -42.0 0.36 Allowed Pre-proline 0 CA--C 1.541 0.624 0 CA-C-N 113.403 -1.726 . . . . 0.0 113.845 166.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.524 ' HD2' ' C ' ' A' 3653 ' ' ILE . 23.6 Cg_endo -65.02 84.16 0.18 Allowed 'Trans proline' 0 C--N 1.359 1.123 0 CA-C-N 120.532 1.226 . . . . 0.0 111.715 173.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 28.6 p80 -152.15 173.35 15.06 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.137 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.551 HD12 HD12 ' A' 3595 ' ' LEU . 35.4 mt -121.98 142.27 50.49 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.165 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.6 ttp -105.16 111.23 23.9 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 176.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.579 HG12 HG12 ' A' 3628 ' ' ILE . 85.5 mt -103.61 119.59 52.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.264 0.554 . . . . 0.0 111.381 -172.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.676 HG13 ' HD2' ' A' 3573 ' ' TYR . 87.1 t -106.35 113.31 42.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.859 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.615 HG12 ' HG ' ' A' 3626 ' ' LEU . 46.8 mt -91.02 113.7 27.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.082 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.58 129.22 56.14 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.71 0.291 . . . . 0.0 111.503 -178.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 4.7 m -71.65 116.54 12.14 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 172.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 45.7 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.527 -0.749 . . . . 0.0 110.567 -177.578 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.518 ' CD1' ' HB2' ' A' 3553 ' ' MET . 22.9 m-85 . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 120.48 0.181 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.892 ' HG3' ' H ' ' B' 2520 ' ' THR . 2.4 tp10 57.69 -159.19 0.26 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.884 0.373 . . . . 0.0 110.281 175.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B 2520 ' ' THR . . . . . 0.892 ' H ' ' HG3' ' B' 2519 ' ' GLU . 89.5 m -150.75 133.7 15.95 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 171.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.565 ' H ' ' C ' ' A' 3550 ' ' ALA . 35.7 tp . . . . . 0 CA--C 1.516 -0.354 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.301 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.555 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp . . . . . 0 N--CA 1.457 -0.092 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.626 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -68.12 -16.38 63.98 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.417 -172.307 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.626 ' N ' HD12 ' A' 3502 ' ' LEU . 0.7 OUTLIER -78.2 -21.03 50.67 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.18 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -98.7 -43.0 6.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.356 0.598 . . . . 0.0 109.74 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.702 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -147.51 100.15 3.81 Favored Pre-proline 0 N--CA 1.444 -0.739 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.773 179.934 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -82.71 173.89 10.03 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 123.985 3.123 . . . . 0.0 113.693 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 90.3 mt -71.23 133.73 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.047 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3508 ' ' VAL . . . . . 0.428 HG11 ' HB2' ' A' 3526 ' ' PHE . 27.0 m -101.95 -30.0 3.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.481 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.759 ' HE3' HD11 ' A' 3524 ' ' LEU . 26.1 t90 -147.04 154.64 41.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.652 0.263 . . . . 0.0 110.373 -174.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -150.59 121.55 7.66 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -175.78 -129.33 1.2 Allowed Glycine 0 N--CA 1.441 -0.976 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -178.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.614 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -140.13 152.18 45.9 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.076 0.465 . . . . 0.0 111.07 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.452 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.0 mt -105.69 149.72 26.12 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 168.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.698 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.55 125.97 14.02 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -177.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.726 HD11 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.86 144.89 41.63 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 172.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.726 ' CD ' HD11 ' A' 3515 ' ' LEU . 0.3 OUTLIER 62.63 -90.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.051 0.54 . . . . 0.0 110.337 -169.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -148.65 12.97 0.91 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.45 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.408 ' O ' ' HA ' ' A' 3514 ' ' ALA . 20.8 m-20 -106.01 144.06 33.26 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.76 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.454 HG23 ' HB1' ' A' 3514 ' ' ALA . 20.0 p -125.94 143.6 51.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.473 -177.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.67 115.06 13.36 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.256 174.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.614 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.44 116.34 12.77 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.956 0.407 . . . . 0.0 109.913 179.007 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.421 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -128.57 148.0 33.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 121.607 0.718 . . . . 0.0 111.75 -175.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -109.26 125.36 52.19 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.854 173.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.759 HD11 ' HE3' ' A' 3509 ' ' TRP . 1.0 OUTLIER -94.51 112.42 24.19 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.39 0.614 . . . . 0.0 111.86 -174.784 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.561 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 62.9 m-70 -88.15 138.53 31.36 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.799 176.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.702 ' O ' ' HB2' ' A' 3505 ' ' TYR . 66.2 t80 -67.28 138.18 56.66 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 174.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.614 ' CG1' HD22 ' A' 3575 ' ' LEU . 21.3 t -114.99 -58.38 3.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.177 0.513 . . . . 0.0 110.971 177.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.5 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 58.3 m -160.2 171.4 19.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.537 -171.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.61 -148.96 20.26 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.125 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.518 ' HB2' ' HA ' ' A' 3571 ' ' THR . 44.0 t-20 -108.23 118.53 37.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.945 0.402 . . . . 0.0 110.117 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.8 p30 -63.34 -28.21 69.85 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.907 -174.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 57.5 t -60.88 -33.47 55.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.752 0.311 . . . . 0.0 110.722 -177.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.516 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 19.7 mt -57.65 -42.68 83.97 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.076 177.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -68.38 -38.44 81.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.881 0.372 . . . . 0.0 110.907 -178.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 29.8 t60 -66.17 -36.48 83.22 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.612 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -89.73 -6.29 56.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.401 ' O ' HG23 ' A' 3614 ' ' VAL . 20.5 p -104.04 -43.34 5.3 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 122.005 -0.434 . . . . 0.0 111.271 176.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.534 HD13 ' HB2' ' A' 3509 ' ' TRP . 22.4 mt -79.36 110.81 16.5 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.982 0.42 . . . . 0.0 110.196 -173.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3539 ' ' PRO . . . . . 0.489 ' HD3' HG23 ' A' 3614 ' ' VAL . 36.6 Cg_endo . . . . . 0 N--CA 1.462 -0.336 0 C-N-CA 122.965 2.443 . . . . 0.0 112.87 -174.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3546 ' ' PRO . . . . . 0.594 ' HA ' ' O ' ' A' 3512 ' ' LEU . 29.0 Cg_endo . . . . . 0 C--O 1.236 0.403 0 N-CA-C 113.211 0.427 . . . . 0.0 113.211 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.591 ' HB3' HD13 ' A' 3612 ' ' ILE . 39.1 mt -69.27 118.64 12.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.834 174.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.698 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -99.22 139.23 35.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 111.643 -174.342 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3549 ' ' ILE . . . . . . . . . . . . . 25.9 mt -95.6 107.83 20.16 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 121.603 0.716 . . . . 0.0 111.609 -175.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.466 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -118.08 1.98 12.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.002 -175.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.658 ' HA ' ' HA ' ' B' 2520 ' ' THR . 62.4 mt-30 -145.64 171.43 14.73 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.527 -0.175 . . . . 0.0 110.527 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.781 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.2 138.89 11.66 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 120.73 0.3 . . . . 0.0 111.172 -179.691 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.562 ' HG3' ' CE1' ' B' 2518 ' ' TYR . 10.8 tmm? -109.67 132.27 54.3 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.116 -0.233 . . . . 0.0 110.885 -178.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3554 ' ' ARG . . . . . 0.425 HH11 ' HD3' ' A' 3554 ' ' ARG . 0.1 OUTLIER -63.71 109.03 1.57 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.181 -179.426 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.53 ' HB2' HD21 ' A' 3560 ' ' LEU . 3.5 pp -81.95 97.27 8.0 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 122.754 1.264 . . . . 0.0 109.411 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.452 ' H ' ' HB2' ' A' 3559 ' ' GLN . 13.9 mm-40 -111.4 166.49 11.08 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.741 -1.572 . . . . 0.0 108.855 177.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.486 ' O ' ' HG3' ' A' 3561 ' ' GLU . . . -54.02 -52.39 60.97 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.973 0.416 . . . . 0.0 111.038 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 25.5 p -65.6 -40.1 92.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.138 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.524 ' O ' HG21 ' A' 3563 ' ' VAL . 15.9 mm100 -65.03 -40.45 94.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.276 -179.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.53 HD21 ' HB2' ' A' 3555 ' ' LEU . 98.5 mt -62.85 -37.94 88.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.772 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' 3557 ' ' ALA . 12.8 mt-10 -68.65 -33.22 73.63 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 175.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3562 ' ' GLY . . . . . 0.466 ' O ' ' HB3' ' A' 3565 ' ' ARG . . . -64.75 -33.52 87.44 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.647 173.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.544 ' O ' ' HG2' ' A' 3566 ' ' ARG . 56.4 t -70.69 -45.75 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 174.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3564 ' ' ALA . . . . . 0.525 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.54 -27.03 64.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.122 178.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.466 ' HB3' ' O ' ' A' 3562 ' ' GLY . 75.5 ttt180 -55.3 -45.02 76.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.178 177.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3566 ' ' ARG . . . . . 0.544 ' HG2' ' O ' ' A' 3563 ' ' VAL . 9.2 ptp180 -87.2 -14.7 40.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.961 0.41 . . . . 0.0 110.844 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.525 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 78.0 mtp -83.3 -20.1 35.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.537 -176.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 11.2 t -88.1 4.04 46.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.959 0.409 . . . . 0.0 110.842 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 46.4 t -127.39 102.65 9.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-O 121.05 0.452 . . . . 0.0 110.748 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3570 ' ' GLU . . . . . 0.576 ' O ' ' HB ' ' A' 3571 ' ' THR . 1.7 mp0 -62.01 139.8 58.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.074 177.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.576 ' HB ' ' O ' ' A' 3570 ' ' GLU . 73.4 m 95.1 -27.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 O-C-N 124.199 0.937 . . . . 0.0 110.069 179.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.01 -31.57 50.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.72 171.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.719 ' HD2' HG11 ' A' 3660 ' ' VAL . 0.2 OUTLIER -138.28 167.17 22.42 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.048 177.708 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.602 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 29.4 t -129.11 135.99 49.62 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 171.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.691 HD11 ' HE2' ' A' 3573 ' ' TYR . 13.9 tp -106.58 126.31 52.11 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.466 HD11 HD22 ' A' 3524 ' ' LEU . 82.4 mt -128.17 151.79 48.82 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.596 -178.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.619 ' HG ' HD13 ' A' 3646 ' ' LEU . 0.3 OUTLIER -118.76 109.11 15.68 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.915 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.46 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.08 119.05 32.39 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.406 0.622 . . . . 0.0 110.469 -177.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.439 ' HG ' HD11 ' A' 3577 ' ' LEU . 82.9 mt -121.57 142.31 35.42 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.73 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.48 134.94 61.47 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.234 1.956 . . . . 0.0 111.359 177.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.2 p -124.52 114.53 19.55 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.142 0.496 . . . . 0.0 110.461 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.23 146.33 16.25 Favored Glycine 0 N--CA 1.443 -0.851 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.588 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 13.1 mtm-85 -62.55 -48.87 77.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.757 0.789 . . . . 0.0 109.359 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.539 ' O ' HG22 ' A' 3588 ' ' VAL . 5.0 m-20 -125.87 174.95 8.01 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.177 -176.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -53.48 -48.4 68.95 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.347 0.404 . . . . 0.0 110.886 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -64.76 -38.96 92.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.58 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 27.8 t70 -65.15 -41.91 94.28 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.218 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.539 HG22 ' O ' ' A' 3584 ' ' ASP . 79.2 t -57.25 -43.61 82.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.501 176.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 11.7 t -62.49 -50.91 77.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.481 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 6.0 m -55.83 -48.58 75.2 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.363 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -64.28 -41.71 96.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.577 0.227 . . . . 0.0 110.848 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3592 ' ' THR . . . . . 0.447 ' O ' ' HG3' ' A' 3596 ' ' LYS . 28.8 m -62.06 -43.84 97.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.033 0.444 . . . . 0.0 109.876 176.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -59.67 -51.08 71.32 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.98 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 32.4 m -59.37 -44.97 92.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.686 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.583 HD12 HD12 ' A' 3657 ' ' LEU . 48.0 tp -62.38 -43.34 99.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.917 -178.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.507 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 55.4 mtmt -59.68 -51.73 68.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.624 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -69.77 -33.63 72.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.291 -175.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -95.45 -46.78 6.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -171.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.477 ' HB2' HD11 ' A' 3595 ' ' LEU . 27.3 m-85 -100.3 -51.03 3.75 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 -174.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.507 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.9 mm -62.38 -60.54 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.359 -173.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 88.0 m -58.0 -39.71 78.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.394 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.621 ' HH ' ' HE3' ' A' 3606 ' ' LYS . 45.6 t80 -71.74 -56.15 6.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.529 -176.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.536 HD11 ' O ' ' A' 3608 ' ' ALA . 0.3 OUTLIER -56.24 -39.81 73.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.726 -0.216 . . . . 0.0 111.329 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -75.88 -30.52 58.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.766 0.317 . . . . 0.0 110.297 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -65.79 -38.69 89.7 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.408 0.623 . . . . 0.0 110.248 176.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3606 ' ' LYS . . . . . 0.621 ' HE3' ' HH ' ' A' 3602 ' ' TYR . 72.2 mmtt -79.5 -18.9 50.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.953 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3607 ' ' GLN . . . . . 0.437 ' O ' ' HG ' ' A' 3555 ' ' LEU . 52.5 mt-30 51.26 51.11 17.6 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -170.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.536 ' O ' HD11 ' A' 3603 ' ' LEU . . . -133.23 -177.68 4.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.739 -174.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.781 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -117.7 118.33 31.8 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.131 176.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3610 ' ' GLY . . . . . 0.523 ' N ' HD12 ' A' 3603 ' ' LEU . . . -64.2 104.18 0.85 Allowed Glycine 0 C--O 1.223 -0.548 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.492 178.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.641 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 37.3 mm -90.0 123.36 42.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.188 0.518 . . . . 0.0 110.95 -175.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.591 HD13 ' HB3' ' A' 3547 ' ' LEU . 40.6 mt -118.52 105.96 18.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.83 175.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.46 ' HA ' ' O ' ' A' 3624 ' ' TYR . 11.7 m120 -84.74 109.33 17.97 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.233 178.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.489 HG23 ' HD3' ' A' 3539 ' ' PRO . 10.7 p . . . . . 0 C--N 1.314 -0.975 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.982 -172.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.46 ' O ' ' HA ' ' A' 3613 ' ' ASN . 70.7 m-85 . . . . . 0 N--CA 1.452 -0.367 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.442 HG11 HD13 ' A' 3611 ' ' ILE . 4.1 t -117.14 115.64 49.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.166 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.614 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -99.31 112.96 25.02 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 170.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.41 ' O ' ' HA ' ' A' 3659 ' ' ILE . 13.5 mt-30 -94.16 111.06 22.76 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.664 -177.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.585 HG12 HG12 ' A' 3659 ' ' ILE . 47.3 mt -93.97 99.46 9.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.548 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -91.17 138.49 25.79 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.451 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.34 168.32 22.65 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.786 2.324 . . . . 0.0 111.677 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -64.81 81.52 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.805 2.337 . . . . 0.0 112.243 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 7.9 p -111.84 162.08 15.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.017 -176.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3633 ' ' GLU . . . . . 0.423 ' CD ' ' H ' ' A' 3633 ' ' GLU . 1.7 mp0 -54.72 -37.84 66.35 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.151 -179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3634 ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' 3560 ' ' LEU . 31.9 t80 -65.87 -42.78 89.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.097 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 67.1 p -62.86 -54.08 44.27 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.968 -178.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3636 ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' 3633 ' ' GLU . 0.6 OUTLIER -59.55 -38.14 80.29 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.643 0.258 . . . . 0.0 111.375 -179.364 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 48.1 t -56.71 -53.19 60.63 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.816 178.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -74.3 -30.57 62.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.949 -178.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3639 ' ' LEU . . . . . 0.446 ' HB3' HD23 ' A' 3647 ' ' LEU . 49.2 mt -62.53 -39.64 94.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.444 0.164 . . . . 0.0 110.891 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.514 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 24.3 m -63.97 -39.66 94.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.198 0.523 . . . . 0.0 110.54 177.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -72.07 -43.4 64.94 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.675 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.588 HD11 HD23 ' A' 3575 ' ' LEU . 20.0 mt -83.5 -42.03 17.33 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.442 -173.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.468 ' HB3' ' CZ ' ' A' 3505 ' ' TYR . . . -142.63 83.5 11.7 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.828 0.347 . . . . 0.0 111.438 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.73 -26.03 28.14 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.666 2.244 . . . . 0.0 113.307 -175.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 5.6 t0 -71.84 -47.83 50.38 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -173.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.619 HD13 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.03 -29.37 49.35 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.359 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.514 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.14 -51.58 63.81 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.892 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.03 -25.4 66.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.933 0.397 . . . . 0.0 111.136 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 17.6 m -79.36 -36.35 39.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.029 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.503 ' HA ' HG21 ' A' 3653 ' ' ILE . 5.4 pt -81.42 -10.44 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.237 0 CA-C-O 120.755 0.312 . . . . 0.0 111.349 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 9.4 t -59.08 -26.53 64.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.142 0.496 . . . . 0.0 109.701 174.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 13.9 m120 -79.68 -41.21 27.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.326 0.584 . . . . 0.0 110.111 175.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.503 HG21 ' HA ' ' A' 3650 ' ' ILE . 8.6 tp -105.29 40.32 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 122.22 1.01 . . . . 0.0 109.821 -177.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.497 ' N ' ' HD2' ' A' 3655 ' ' PRO . 50.8 m -40.43 -40.61 2.08 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-N 114.521 -1.218 . . . . 0.0 113.6 173.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' 3654 ' ' SER . 14.9 Cg_endo -60.24 78.57 0.07 OUTLIER 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 121.568 1.512 . . . . 0.0 111.864 169.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3656 ' ' HIS . . . . . 0.422 ' CB ' HD21 ' A' 3579 ' ' LEU . 32.6 p80 -150.46 -178.64 6.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.636 -179.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.583 HD12 HD12 ' A' 3595 ' ' LEU . 24.0 mt -124.74 142.59 51.3 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.71 -178.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 61.2 ttp -102.69 110.99 23.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.585 HG12 HG12 ' A' 3628 ' ' ILE . 84.0 mt -103.88 121.29 55.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-O 121.306 0.574 . . . . 0.0 111.492 -173.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.719 HG11 ' HD2' ' A' 3573 ' ' TYR . 85.1 t -107.27 116.4 50.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.661 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.614 HG12 ' HG ' ' A' 3626 ' ' LEU . 64.3 mt -90.81 112.19 24.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 177.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -108.52 128.52 54.88 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.881 0.372 . . . . 0.0 111.322 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 9.2 m -68.95 114.63 7.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.005 174.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 63.2 t . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.914 -0.565 . . . . 0.0 110.155 179.196 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.562 ' CE1' ' HG3' ' A' 3553 ' ' MET . 8.0 m-85 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 111.172 0.064 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.566 ' HG2' ' H ' ' B' 2520 ' ' THR . 15.7 tt0 57.01 -158.74 0.26 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 177.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B 2520 ' ' THR . . . . . 0.658 ' HA ' ' HA ' ' A' 3551 ' ' GLN . 8.0 t -157.44 124.55 5.13 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 172.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.584 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.591 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.3 pp . . . . . 0 CA--C 1.528 0.111 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.712 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -71.82 -13.65 61.75 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.429 -173.301 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.536 ' N ' HD11 ' A' 3502 ' ' LEU . 51.4 tptt -67.64 -23.7 65.37 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 174.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3504 ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' 3504 ' ' LYS . 36.0 mmtm -103.27 -42.66 5.67 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.261 176.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.674 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -146.87 103.08 3.88 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-O 121.471 0.653 . . . . 0.0 110.796 179.252 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3506 ' ' PRO . . . . . 0.712 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 94.0 Cg_endo -82.11 174.39 10.1 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 123.972 3.115 . . . . 0.0 113.556 -176.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.51 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 82.1 mt -71.22 133.12 32.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.536 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3508 ' ' VAL . . . . . 0.446 HG12 ' HB2' ' A' 3526 ' ' PHE . 33.8 m -101.89 -24.55 4.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.364 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.591 ' CB ' HD11 ' A' 3538 ' ' LEU . 50.4 t-105 -156.13 154.73 31.34 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.805 0.336 . . . . 0.0 110.786 -176.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -147.57 120.08 8.5 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -171.1 -132.92 1.54 Allowed Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.723 -177.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -139.83 149.0 42.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.182 0.515 . . . . 0.0 111.546 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.464 HD23 ' HB2' ' A' 3547 ' ' LEU . 93.8 mt -105.1 144.38 31.97 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 170.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.684 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -141.98 124.44 15.74 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.738 0.304 . . . . 0.0 111.61 -177.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.681 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.31 146.37 44.54 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 173.903 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.681 ' CD ' HD12 ' A' 3515 ' ' LEU . 1.2 mptm? 62.64 -93.69 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -167.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 22.4 m120 -147.26 11.95 1.04 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.343 175.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.443 ' O ' ' HA ' ' A' 3514 ' ' ALA . 3.9 t0 -100.09 138.72 36.78 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.129 -175.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.555 HG23 ' HB2' ' A' 3514 ' ' ALA . 28.0 p -123.58 127.69 48.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.087 0.47 . . . . 0.0 111.88 -175.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -120.71 115.64 23.72 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.395 175.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.546 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.75 120.78 18.85 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.428 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -130.38 147.93 33.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.538 0.685 . . . . 0.0 111.834 -175.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -111.1 126.09 54.46 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.986 173.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.567 HD21 HD11 ' A' 3576 ' ' LEU . 0.8 OUTLIER -95.51 112.63 24.31 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.34 0.59 . . . . 0.0 111.986 -173.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.51 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 74.9 m-70 -85.53 140.28 30.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.757 174.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.674 ' O ' ' HB2' ' A' 3505 ' ' TYR . 58.9 t80 -70.17 136.64 50.28 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 175.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.646 ' CG1' HD23 ' A' 3575 ' ' LEU . 19.6 t -115.36 -51.96 4.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.081 0.467 . . . . 0.0 111.372 178.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 25.8 t -162.19 170.39 19.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.706 -170.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.25 -149.21 21.19 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.854 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.5 t-20 -104.7 117.02 33.05 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.773 0.32 . . . . 0.0 110.713 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 12.2 p30 -61.15 -36.28 79.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3532 ' ' VAL . . . . . 0.422 HG13 ' HD2' ' A' 3536 ' ' ARG . 57.8 t -59.95 -33.41 52.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.559 0.218 . . . . 0.0 110.489 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.51 HD21 ' HD3' ' A' 3536 ' ' ARG . 16.4 mt -56.7 -40.99 76.6 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.235 178.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.423 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.81 -47.26 72.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.885 0.374 . . . . 0.0 110.378 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -59.89 -35.59 75.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.946 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3536 ' ' ARG . . . . . 0.51 ' HD3' HD21 ' A' 3533 ' ' LEU . 12.4 ptm180 -88.95 -11.09 45.37 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.505 ' O ' HG22 ' A' 3614 ' ' VAL . 57.5 p -103.05 -37.52 7.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.976 0.417 . . . . 0.0 111.227 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.591 HD11 ' CB ' ' A' 3509 ' ' TRP . 21.3 mt -78.88 112.01 24.14 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -174.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo . . . . . 0 N--CA 1.461 -0.403 0 C-N-CA 123.255 2.636 . . . . 0.0 113.989 -166.718 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo . . . . . 0 N--CA 1.463 -0.278 0 CA-C-O 120.996 0.332 . . . . 0.0 112.614 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.555 ' HB3' HD11 ' A' 3612 ' ' ILE . 57.0 mt -78.0 118.05 19.91 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.264 177.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.684 ' HA ' ' O ' ' A' 3514 ' ' ALA . 23.8 ptt180 -103.52 141.62 35.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.074 0.464 . . . . 0.0 111.401 -177.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.457 HD12 HD11 ' A' 3628 ' ' ILE . 19.5 mt -94.12 107.23 19.04 Favored 'Isoleucine or valine' 0 C--O 1.254 1.326 0 CA-C-O 122.705 1.24 . . . . 0.0 111.648 -172.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.419 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -108.94 -6.52 15.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.891 -173.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.648 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 52.6 mt-30 -148.29 176.95 9.83 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.363 0.125 . . . . 0.0 111.142 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.71 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -155.83 136.79 13.62 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.884 0.374 . . . . 0.0 111.585 -178.945 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.593 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 14.1 tmm? -110.39 121.67 45.85 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.398 177.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -71.78 110.64 6.45 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.532 ' HB2' HD22 ' A' 3560 ' ' LEU . 2.9 pp -71.98 98.65 2.09 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 122.278 1.037 . . . . 0.0 110.054 -176.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.597 ' O ' ' HG ' ' A' 3560 ' ' LEU . 43.4 mt-10 -113.09 166.42 11.45 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.309 176.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -53.24 -47.48 68.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.063 0.459 . . . . 0.0 111.11 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 1.6 p -63.04 -38.39 91.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.507 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.854 HE21 ' HA ' ' A' 3559 ' ' GLN . 0.0 OUTLIER -74.27 -37.59 63.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.168 -177.521 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' 3556 ' ' GLU . 86.0 mt -61.72 -35.32 77.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.729 0.3 . . . . 0.0 110.488 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -62.85 -46.17 89.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.961 173.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -62.32 -34.07 88.1 Favored Glycine 0 CA--C 1.519 0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.499 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.567 ' O ' ' HG3' ' A' 3567 ' ' MET . 59.2 t -66.87 -49.5 73.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3564 ' ' ALA . . . . . 0.547 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.74 -27.54 68.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.063 178.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -54.76 -47.34 74.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.533 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.2 ptp85 -85.17 -14.41 47.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.078 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.567 ' HG3' ' O ' ' A' 3563 ' ' VAL . 87.6 mtp -83.08 -19.58 36.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.804 0.335 . . . . 0.0 111.153 -179.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3568 ' ' THR . . . . . 0.436 HG23 ' O ' ' A' 3564 ' ' ALA . 37.0 p -80.36 -21.45 42.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.144 0.497 . . . . 0.0 110.549 177.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 23.3 t -106.19 78.65 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.572 177.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.66 108.21 1.99 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.665 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.557 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.7 m 155.96 -45.85 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.373 1.469 . . . . 0.0 107.732 -173.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -86.76 -14.86 41.11 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.295 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.645 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -134.81 162.88 31.12 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.758 175.475 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.581 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 34.2 t -128.23 133.94 48.92 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.646 HD23 ' CG1' ' A' 3527 ' ' VAL . 12.6 tp -105.61 125.41 50.96 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.567 HD11 HD21 ' A' 3524 ' ' LEU . 81.4 mt -125.78 154.52 42.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.85 -177.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.716 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.72 108.14 13.62 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.186 179.76 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.494 ' HB2' HD11 ' A' 3659 ' ' ILE . . . -94.28 123.64 37.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.236 0.541 . . . . 0.0 110.591 -178.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.417 ' O ' ' HA ' ' A' 3522 ' ' VAL . 73.7 mt -124.63 143.71 44.22 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.258 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.47 117.96 4.78 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.46 2.107 . . . . 0.0 112.21 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.7 p -110.08 119.62 39.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.127 0.489 . . . . 0.0 110.029 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -102.82 145.19 16.27 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.735 -177.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 44.3 mtm180 -70.52 -25.18 63.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.782 0.801 . . . . 0.0 109.87 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.565 ' O ' HG23 ' A' 3588 ' ' VAL . 23.9 t70 -147.9 169.95 18.72 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.354 -1.294 . . . . 0.0 108.257 -175.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.53 -49.59 67.3 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -60.93 -37.96 84.14 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.688 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.497 ' O ' ' HG2' ' A' 3591 ' ' GLN . 6.4 t70 -66.97 -40.83 87.53 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.548 -177.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' 3584 ' ' ASP . 94.1 t -58.68 -39.49 76.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.178 0.514 . . . . 0.0 110.385 178.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 3.0 t -63.49 -48.27 87.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.457 177.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 71.9 m -58.72 -47.31 85.02 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 114.178 -1.374 . . . . 0.0 111.703 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3591 ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' 3587 ' ' ASP . 71.6 mm-40 -63.87 -45.08 91.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.478 0.18 . . . . 0.0 110.758 -179.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 46.3 m -57.59 -47.4 82.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.16 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.91 -50.7 72.37 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.887 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 19.4 m -60.65 -45.25 94.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.187 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.558 HD13 HD13 ' A' 3657 ' ' LEU . 44.8 tp -64.08 -45.93 86.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.568 -175.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.779 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -71.29 -25.55 62.49 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.061 -176.164 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.55 -40.56 18.96 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.403 178.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.48 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -92.36 -45.97 7.92 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -171.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.506 ' HB2' HD12 ' A' 3595 ' ' LEU . 21.1 m-85 -98.47 -50.17 4.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.256 -174.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.779 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 21.8 mm -61.46 -58.09 9.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.738 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 98.0 m -55.57 -41.06 72.77 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 123.352 0.407 . . . . 0.0 111.456 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.779 ' CE2' HD21 ' A' 3603 ' ' LEU . 0.1 OUTLIER -68.48 -56.98 6.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.614 -0.267 . . . . 0.0 111.333 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.779 HD21 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.52 -43.55 79.89 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.526 0.203 . . . . 0.0 111.521 -177.182 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -68.07 -37.29 81.1 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.496 -177.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.25 -37.3 77.88 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.038 0.447 . . . . 0.0 110.822 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -77.35 -18.6 57.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.824 179.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 50.03 53.03 13.54 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -169.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.438 ' O ' HD13 ' A' 3603 ' ' LEU . . . -135.69 -176.02 4.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.312 -171.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.71 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.05 118.26 30.15 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.499 176.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3610 ' ' GLY . . . . . 0.437 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.93 103.78 0.84 Allowed Glycine 0 C--O 1.222 -0.605 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.485 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.648 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 31.0 mm -88.99 120.37 37.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.175 0.512 . . . . 0.0 111.055 -174.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.555 HD11 ' HB3' ' A' 3547 ' ' LEU . 35.0 mt -119.24 117.83 55.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.879 176.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.534 ' HA ' ' O ' ' A' 3624 ' ' TYR . 15.9 m120 -96.73 126.04 41.62 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.348 -178.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.564 HG21 ' HB2' ' A' 3624 ' ' TYR . 3.4 m . . . . . 0 C--N 1.32 -0.691 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 176.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.564 ' HB2' HG21 ' A' 3614 ' ' VAL . 19.5 m-85 . . . . . 0 CA--C 1.513 -0.451 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.401 HG13 HD12 ' A' 3611 ' ' ILE . 10.7 t -117.76 114.12 44.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.555 177.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.603 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -99.36 111.19 23.6 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 169.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.54 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 40.5 mt-30 -93.85 111.76 23.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.928 -178.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.577 HG12 HG12 ' A' 3659 ' ' ILE . 42.1 mt -89.14 98.05 7.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.166 178.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -87.48 141.94 32.69 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.86 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.506 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 53.4 Cg_endo -69.3 172.96 11.27 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 122.656 2.237 . . . . 0.0 111.513 176.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.88 40.36 0.42 Allowed 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.801 2.334 . . . . 0.0 112.571 176.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.423 ' H ' ' C ' ' A' 3630 ' ' PRO . 22.6 p -72.05 161.63 30.62 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.852 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -51.2 -39.58 56.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.003 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 33.9 t80 -50.76 -53.88 28.03 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.04 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 5.6 m -62.72 -56.81 14.24 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.92 -177.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.45 -41.81 69.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.881 -175.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 21.3 m -67.46 -47.89 68.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.128 -176.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -64.24 -35.77 81.9 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.271 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.22 -34.16 77.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.962 176.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.655 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 37.7 m -67.02 -29.63 69.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.76 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.59 -56.45 3.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.166 176.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.592 HD12 HD21 ' A' 3575 ' ' LEU . 19.2 mt -66.04 -38.5 88.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.342 -171.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.403 ' CB ' HG12 ' A' 3527 ' ' VAL . . . -144.81 74.57 14.74 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.834 -0.166 . . . . 0.0 111.385 -178.183 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -67.76 -19.21 47.5 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.393 2.062 . . . . 0.0 111.74 -178.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3645 ' ' ASP . . . . . 0.567 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.5 m-20 -73.5 -51.58 16.6 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.004 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.716 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -77.85 -30.09 50.82 Favored 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -179.58 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.655 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -53.82 -47.34 70.97 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.33 177.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.55 -28.95 68.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.058 0.456 . . . . 0.0 111.148 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 20.1 m -81.44 -33.34 32.16 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.041 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.54 ' HA ' HG21 ' A' 3653 ' ' ILE . 4.8 pt -83.95 -10.44 11.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.235 -178.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 38.4 m -55.36 -33.61 63.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.361 176.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -84.0 -33.01 24.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.647 179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.54 HG21 ' HA ' ' A' 3650 ' ' ILE . 9.5 tp -105.43 38.31 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 122.41 1.1 . . . . 0.0 109.335 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.488 ' N ' ' HD2' ' A' 3655 ' ' PRO . 22.9 t -39.27 -40.84 1.39 Allowed Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 113.996 -1.456 . . . . 0.0 113.606 173.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' 3654 ' ' SER . 17.6 Cg_endo -60.21 80.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 121.647 1.565 . . . . 0.0 111.597 168.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 21.7 p80 -146.72 177.14 9.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.687 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.558 HD13 HD13 ' A' 3595 ' ' LEU . 39.1 mt -122.41 146.93 46.9 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.278 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 61.6 ttp -109.05 107.28 17.55 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 174.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.577 HG12 HG12 ' A' 3628 ' ' ILE . 81.2 mt -99.05 116.35 41.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.295 0.569 . . . . 0.0 111.218 -172.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.645 HG13 ' HD2' ' A' 3573 ' ' TYR . 94.0 t -103.07 113.91 41.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.993 -177.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.603 HG12 ' HG ' ' A' 3626 ' ' LEU . 62.7 mt -90.56 122.15 41.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.154 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -116.89 127.94 54.76 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.354 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 5.2 p -93.13 131.98 37.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.097 0.475 . . . . 0.0 110.868 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 30.6 t . . . . . 0 C--O 1.244 0.812 0 CA-C-O 118.785 -0.626 . . . . 0.0 110.021 179.231 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.593 ' CD1' ' HB2' ' A' 3553 ' ' MET . 24.5 m-85 . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 111.223 0.083 . . . . 0.0 111.223 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.484 ' CB ' ' HG2' ' A' 3552 ' ' ARG . 0.4 OUTLIER 54.96 -162.04 0.15 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.613 0.721 . . . . 0.0 111.704 177.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B 2520 ' ' THR . . . . . 0.465 ' HA ' ' HG2' ' A' 3551 ' ' GLN . 18.7 m -147.3 123.53 10.88 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 168.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.444 HD11 ' HD2' ' A' 3552 ' ' ARG . 34.9 tp . . . . . 0 CA--C 1.512 -0.517 0 C-N-CA 119.54 -0.864 . . . . 0.0 109.956 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp . . . . . 0 CA--C 1.528 0.101 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.608 HD11 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.46 -15.73 62.85 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.683 -172.071 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.608 ' N ' HD11 ' A' 3502 ' ' LEU . 18.6 tptm -74.58 -16.3 60.81 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3504 ' ' LYS . . . . . 0.42 ' HA ' ' HD3' ' A' 3504 ' ' LYS . 44.3 mmtm -105.23 -43.11 5.09 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.818 173.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.722 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.68 102.48 3.45 Favored Pre-proline 0 N--CA 1.447 -0.614 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.24 -178.759 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -85.97 174.25 6.5 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 124.347 3.365 . . . . 0.0 113.602 -178.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.548 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 97.6 mt -71.98 137.18 24.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.938 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 29.6 m -104.24 -24.75 3.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.654 -178.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.602 ' HE3' HD11 ' A' 3524 ' ' LEU . 39.2 t90 -158.22 152.6 24.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.38 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3510 ' ' GLN . . . . . 0.434 ' HG3' ' HB3' ' A' 3523 ' ' GLN . 26.2 tt0 -148.2 119.94 8.08 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -166.54 -128.72 1.0 Allowed Glycine 0 N--CA 1.442 -0.948 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -178.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.66 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.0 mp -139.18 156.63 46.97 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.161 0.505 . . . . 0.0 111.101 178.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.463 HD23 ' HB2' ' A' 3547 ' ' LEU . 72.7 mt -109.48 151.67 26.41 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 169.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.764 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.76 124.04 13.0 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.698 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.607 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.08 142.9 38.14 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 171.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.607 ' HD3' HD12 ' A' 3515 ' ' LEU . 2.0 mptp? 63.79 -95.01 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -169.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 7.0 m120 -143.38 9.65 1.64 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.007 -0.997 . . . . 0.0 108.73 175.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.453 ' O ' ' HA ' ' A' 3514 ' ' ALA . 13.4 m-20 -94.89 128.75 41.89 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.164 -175.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.433 ' HA ' ' O ' ' A' 3513 ' ' LEU . 29.0 p -118.45 134.48 55.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.059 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -129.04 116.37 19.2 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.591 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.48 119.59 14.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.933 0.397 . . . . 0.0 109.955 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.433 ' HA ' ' O ' ' A' 3579 ' ' LEU . 28.0 m -128.08 147.55 32.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.664 0.745 . . . . 0.0 111.867 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3523 ' ' GLN . . . . . 0.434 ' HB3' ' HG3' ' A' 3510 ' ' GLN . 4.4 pt20 -112.29 125.17 53.88 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.599 -1.182 . . . . 0.0 108.58 173.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.613 HD21 HD13 ' A' 3576 ' ' LEU . 0.7 OUTLIER -96.89 112.34 24.14 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.278 0.561 . . . . 0.0 111.851 -174.773 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.548 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 73.5 m-70 -82.98 138.69 33.68 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.113 -0.948 . . . . 0.0 108.646 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.722 ' O ' ' HB2' ' A' 3505 ' ' TYR . 68.5 t80 -66.41 136.34 55.61 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 173.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.633 ' CG1' HD23 ' A' 3575 ' ' LEU . 18.9 t -115.2 -54.56 4.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 121.247 0.546 . . . . 0.0 110.931 177.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 28.7 t -159.1 170.42 22.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.124 -169.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.11 -147.11 20.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.23 174.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.536 ' HB2' ' HA ' ' A' 3571 ' ' THR . 41.9 t30 -107.6 108.97 20.48 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -63.17 -26.66 68.91 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.706 -175.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 47.4 t -59.27 -32.31 48.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.636 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.496 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 25.2 mt -57.8 -44.6 86.44 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.009 177.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -65.0 -42.19 94.69 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 120.765 0.317 . . . . 0.0 110.642 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -58.34 -41.57 84.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.695 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -89.98 -4.95 57.17 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3537 ' ' SER . . . . . . . . . . . . . 13.3 p -104.43 -40.68 5.98 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.891 -0.506 . . . . 0.0 111.514 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.602 HD11 ' CB ' ' A' 3509 ' ' TRP . 22.9 mt -80.32 115.68 56.46 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-O 121.208 0.528 . . . . 0.0 110.874 -172.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3539 ' ' PRO . . . . . 0.43 ' HD3' HG22 ' A' 3614 ' ' VAL . 58.6 Cg_endo . . . . . 0 N--CA 1.46 -0.494 0 C-N-CA 123.03 2.487 . . . . 0.0 112.979 -176.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3546 ' ' PRO . . . . . 0.66 ' HA ' ' O ' ' A' 3512 ' ' LEU . 56.4 Cg_endo . . . . . 0 N--CA 1.454 -0.824 0 CA-C-O 121.094 0.372 . . . . 0.0 112.76 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.596 ' HB3' HD11 ' A' 3612 ' ' ILE . 37.1 mt -68.3 109.69 3.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.218 174.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.764 ' HA ' ' O ' ' A' 3514 ' ' ALA . 14.9 ptt180 -96.1 139.73 31.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.358 0.599 . . . . 0.0 111.48 -173.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.404 HD11 HD22 ' A' 3515 ' ' LEU . 19.8 mt -93.82 107.81 19.75 Favored 'Isoleucine or valine' 0 C--O 1.245 0.848 0 CA-C-O 122.037 0.922 . . . . 0.0 111.603 -172.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.471 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -116.85 5.37 13.0 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.363 -175.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.695 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 42.3 mt-30 -149.4 165.82 30.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.391 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.689 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -155.09 138.31 15.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 0.0 110.923 -179.783 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.548 ' HG3' ' CE2' ' B' 2518 ' ' TYR . 13.7 tmm? -111.25 121.54 45.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.5 177.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -63.01 109.88 1.62 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.623 HD11 ' O ' ' A' 3555 ' ' LEU . 3.4 pp -70.06 99.16 1.41 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 122.5 1.143 . . . . 0.0 109.703 -177.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.438 ' O ' ' HG ' ' A' 3560 ' ' LEU . 8.4 mm-40 -104.91 152.39 22.71 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.291 178.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -53.25 -48.23 68.4 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 175.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 22.2 m -58.08 -43.84 87.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.597 176.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.527 ' O ' HG21 ' A' 3563 ' ' VAL . 12.1 mm100 -66.06 -45.7 80.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.999 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' 3556 ' ' GLU . 94.0 mt -62.88 -36.38 83.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.447 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' 3557 ' ' ALA . 8.7 mm-40 -56.19 -51.19 68.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.39 172.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -60.9 -41.73 99.4 Favored Glycine 0 CA--C 1.521 0.431 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.548 178.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.527 HG21 ' O ' ' A' 3559 ' ' GLN . 63.1 t -62.6 -48.88 86.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.882 0.372 . . . . 0.0 110.456 177.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.78 -30.92 69.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.71 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.5 ' O ' ' HB ' ' A' 3568 ' ' THR . 34.5 ttm180 -60.53 -40.65 92.26 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.741 0.305 . . . . 0.0 111.192 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -86.6 -10.01 54.84 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.335 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.519 ' HE2' HD13 ' A' 3575 ' ' LEU . 83.1 mtp -83.25 -20.51 34.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.961 0.886 . . . . 0.0 108.969 171.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3568 ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' 3565 ' ' ARG . 23.2 m -75.5 -15.54 60.39 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 114.174 -1.376 . . . . 0.0 110.26 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 47.7 t -116.45 90.09 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.987 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.39 108.26 4.17 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.536 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 153.26 -45.48 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 O-C-N 125.057 1.473 . . . . 0.0 107.98 -174.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.08 -30.71 58.42 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.602 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.756 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -126.76 165.79 18.62 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.392 179.269 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.594 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 51.2 t -127.42 134.53 49.88 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 171.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.633 HD23 ' CG1' ' A' 3527 ' ' VAL . 15.2 tp -105.56 126.91 52.68 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.613 HD13 HD21 ' A' 3524 ' ' LEU . 76.9 mt -125.9 154.51 42.65 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.149 0.5 . . . . 0.0 110.934 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.731 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -121.55 108.33 13.48 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.074 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.468 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 123.33 37.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.365 0.602 . . . . 0.0 110.748 -177.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' 3522 ' ' VAL . 85.5 mt -123.35 143.59 41.64 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.943 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -61.8 110.99 1.07 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.341 2.028 . . . . 0.0 112.038 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.4 p -95.97 114.33 26.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.337 0.589 . . . . 0.0 110.532 -178.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.93 145.9 16.22 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.542 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -60.19 -47.69 84.88 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 123.728 0.811 . . . . 0.0 110.73 175.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.536 ' O ' HG21 ' A' 3588 ' ' VAL . 2.2 p30 -134.92 179.78 6.1 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.3 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -54.98 -46.65 75.12 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.246 0.341 . . . . 0.0 111.57 -175.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -67.31 -40.82 86.05 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 19.5 t70 -60.61 -42.53 97.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.289 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.536 HG21 ' O ' ' A' 3584 ' ' ASP . 81.1 t -57.46 -49.26 80.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.368 176.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3589 ' ' VAL . . . . . 0.435 ' O ' ' HG2' ' A' 3593 ' ' GLU . 93.7 t -59.66 -49.37 83.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.369 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 29.7 t -59.43 -43.2 93.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.24 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -68.9 -36.09 77.62 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.841 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 88.5 m -63.01 -54.29 40.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.857 0.36 . . . . 0.0 110.78 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3593 ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.9 pt-20 -62.88 -34.68 77.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.32 -178.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 50.6 m -70.22 -42.09 72.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.647 0.261 . . . . 0.0 110.721 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.578 HD13 HD11 ' A' 3657 ' ' LEU . 58.8 tp -63.15 -45.48 91.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.999 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.812 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 21.2 ptmt -67.51 -29.82 69.33 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.657 -0.417 . . . . 0.0 111.161 -178.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -80.97 -40.78 23.87 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.745 0.307 . . . . 0.0 111.656 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -90.71 -46.54 8.19 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -171.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.482 ' HB2' HD11 ' A' 3595 ' ' LEU . 9.5 m-85 -98.34 -50.01 4.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.719 0.295 . . . . 0.0 111.323 -174.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.812 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 25.6 mm -60.66 -55.03 27.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.721 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 73.3 m -56.27 -39.79 73.18 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 123.295 0.372 . . . . 0.0 110.977 179.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.818 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.1 OUTLIER -66.68 -57.65 6.73 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.063 179.008 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.818 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.93 -41.25 77.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 -177.704 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 3604 ' ' GLN . . . . . 0.415 HE21 ' HB2' ' A' 3604 ' ' GLN . 0.0 OUTLIER -72.9 -37.1 67.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.698 -177.127 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.16 -33.88 72.32 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.973 0.416 . . . . 0.0 110.848 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -81.16 -19.04 44.26 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.837 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3607 ' ' GLN . . . . . 0.443 ' O ' ' HG ' ' A' 3555 ' ' LEU . 89.8 mt-30 46.31 61.32 2.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.376 0.608 . . . . 0.0 109.582 -168.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.429 ' O ' HD13 ' A' 3603 ' ' LEU . . . -137.84 -177.68 4.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.588 -173.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.689 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -118.19 117.89 30.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.212 173.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.02 101.14 0.45 Allowed Glycine 0 C--O 1.223 -0.571 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.695 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 31.4 mm -89.4 127.7 41.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 121.264 0.554 . . . . 0.0 110.977 -173.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.596 HD11 ' HB3' ' A' 3547 ' ' LEU . 71.5 mt -128.7 105.1 12.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.025 -0.989 . . . . 0.0 109.961 177.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.574 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.6 m120 -81.0 116.84 21.16 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 172.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.43 HG22 ' HD3' ' A' 3539 ' ' PRO . 8.0 p . . . . . 0 C--N 1.309 -1.16 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.42 -176.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.574 ' O ' ' HA ' ' A' 3613 ' ' ASN . 92.3 m-85 . . . . . 0 N--CA 1.446 -0.654 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.409 HG13 HG22 ' A' 3611 ' ' ILE . 3.3 t -120.51 113.66 40.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.766 176.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.604 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.3 mp -94.98 112.25 23.97 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 171.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.455 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 36.8 mt-30 -93.99 110.71 22.38 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.299 -178.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.573 HG12 HG12 ' A' 3659 ' ' ILE . 48.0 mt -90.3 97.86 7.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.954 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -89.13 143.13 30.68 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.823 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.523 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 48.5 Cg_endo -69.12 169.26 18.5 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.305 2.004 . . . . 0.0 111.039 175.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -68.64 55.16 0.85 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.115 2.544 . . . . 0.0 112.433 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.431 ' O ' ' HG2' ' A' 3636 ' ' GLU . 8.5 p -83.22 162.32 21.25 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.748 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.06 -42.3 76.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.355 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 19.9 t80 -60.41 -40.05 89.62 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.864 0.364 . . . . 0.0 110.272 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 12.4 t -61.33 -59.1 5.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.637 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3636 ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' 3632 ' ' CYS . 7.9 mm-40 -65.19 -34.0 77.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.297 -173.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 30.6 t -65.25 -48.72 72.29 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.908 0.385 . . . . 0.0 110.264 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -67.21 -32.02 72.8 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.353 178.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3639 ' ' LEU . . . . . 0.459 ' HB3' HD23 ' A' 3647 ' ' LEU . 65.0 mt -63.16 -40.32 97.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.899 175.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.613 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 38.0 m -63.83 -31.82 73.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.362 0.601 . . . . 0.0 110.153 178.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -80.11 -45.97 17.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.014 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.591 HD12 HD22 ' A' 3575 ' ' LEU . 19.5 mt -82.37 -35.0 28.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.564 -0.744 . . . . 0.0 112.449 -172.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.455 ' HB2' ' CZ ' ' A' 3505 ' ' TYR . . . -147.86 82.57 7.83 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.86 0.362 . . . . 0.0 111.124 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.23 -26.9 48.92 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.804 2.336 . . . . 0.0 113.377 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 8.0 t70 -75.34 -52.12 11.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.096 0.474 . . . . 0.0 110.197 -173.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.731 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -71.14 -29.31 65.07 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.598 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.613 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -55.26 -52.24 64.03 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.811 0.338 . . . . 0.0 110.622 178.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.79 -28.61 68.88 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.042 0.449 . . . . 0.0 110.682 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 20.3 m -76.79 -35.19 57.8 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.114 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.498 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.4 pt -83.07 -9.92 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.413 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.5 m -63.85 -16.38 61.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.214 0.53 . . . . 0.0 110.114 175.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 47.4 t30 -87.94 -38.72 15.34 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.904 173.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.51 ' O ' HG13 ' A' 3653 ' ' ILE . 7.7 tp -105.25 41.08 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 122.527 1.156 . . . . 0.0 109.66 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.475 ' N ' ' HD2' ' A' 3655 ' ' PRO . 14.7 m -38.05 -43.06 1.52 Allowed Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 114.008 -1.451 . . . . 0.0 113.747 172.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' 3654 ' ' SER . 19.6 Cg_endo -61.27 77.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 121.631 1.554 . . . . 0.0 111.818 169.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 25.9 p80 -142.82 174.61 10.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.981 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.578 HD11 HD13 ' A' 3595 ' ' LEU . 36.9 mt -120.63 142.05 49.79 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.301 178.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 13.3 tmm? -105.84 109.64 21.66 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.573 HG12 HG12 ' A' 3628 ' ' ILE . 74.6 mt -105.38 119.05 53.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.264 0.554 . . . . 0.0 111.499 -171.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.756 HG13 ' HD2' ' A' 3573 ' ' TYR . 81.0 t -102.68 116.6 46.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.686 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.604 HG12 ' HG ' ' A' 3626 ' ' LEU . 54.3 mt -90.53 111.86 24.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.49 128.14 56.34 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 120.97 0.414 . . . . 0.0 111.503 -177.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 8.5 m -74.06 142.11 45.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.714 171.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 84.1 t . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.418 -0.801 . . . . 0.0 109.612 175.452 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.548 ' CE2' ' HG3' ' A' 3553 ' ' MET . 1.5 m-85 . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 120.538 0.208 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.64 ' O ' ' HG2' ' A' 3551 ' ' GLN . 48.4 tt0 59.29 -175.6 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -177.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 6.2 p -140.59 123.83 16.71 Favored 'General case' 0 C--N 1.317 -0.831 0 O-C-N 121.795 -0.566 . . . . 0.0 110.211 178.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.483 HD12 ' HD2' ' A' 3552 ' ' ARG . 20.7 tp . . . . . 0 N--CA 1.452 -0.372 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.245 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.593 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.2 pp . . . . . 0 N--CA 1.457 -0.12 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.607 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.85 -15.46 62.64 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 120.049 -0.661 . . . . 0.0 110.023 -174.258 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.607 ' N ' HD12 ' A' 3502 ' ' LEU . 26.8 tptp -66.77 -33.53 75.83 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.882 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 22.0 mttp -98.73 -43.72 6.68 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.141 0.496 . . . . 0.0 110.849 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.732 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -143.75 97.01 5.49 Favored Pre-proline 0 N--CA 1.441 -0.891 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.379 -176.489 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -81.85 174.17 10.51 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 124.045 3.163 . . . . 0.0 113.533 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.455 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 74.3 mt -71.33 135.79 27.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.647 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 32.8 m -109.04 -24.39 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.927 -176.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.658 ' HE3' HD12 ' A' 3524 ' ' LEU . 34.6 t90 -151.3 153.72 35.37 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.673 0.273 . . . . 0.0 110.362 -176.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -150.92 119.76 6.61 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -176.32 -134.02 1.88 Allowed Glycine 0 N--CA 1.445 -0.751 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.596 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -136.32 154.45 50.86 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.194 0.521 . . . . 0.0 111.334 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.454 HD22 ' HB2' ' A' 3547 ' ' LEU . 78.1 mt -107.45 152.76 23.78 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 170.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.684 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -148.29 123.64 10.29 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -177.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.577 HD13 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.81 143.46 38.91 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 173.117 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.577 ' HD3' HD13 ' A' 3515 ' ' LEU . 0.4 OUTLIER 62.87 -94.97 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 -169.294 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -142.91 10.44 1.77 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 173.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.496 ' O ' ' HA ' ' A' 3514 ' ' ALA . 62.2 m-20 -91.88 128.31 37.68 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.55 -174.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 11.9 p -119.13 137.74 53.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.337 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -137.26 118.69 14.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.458 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.596 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.96 124.84 26.25 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 177.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.405 ' HA ' ' O ' ' A' 3579 ' ' LEU . 29.5 m -134.4 147.61 29.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.609 0.718 . . . . 0.0 111.862 -175.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3523 ' ' GLN . . . . . 0.535 ' HG2' ' HB3' ' A' 3581 ' ' CYS . 9.1 pt20 -111.47 125.61 54.08 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.023 -0.99 . . . . 0.0 108.709 171.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.658 HD12 ' HE3' ' A' 3509 ' ' TRP . 2.2 mt -93.29 111.68 23.39 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.86 -175.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.455 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 68.2 m-70 -85.05 138.01 32.7 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.209 -0.905 . . . . 0.0 108.897 174.014 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.732 ' O ' ' HB2' ' A' 3505 ' ' TYR . 66.0 t80 -67.59 141.15 56.89 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 173.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.635 ' CG1' HD21 ' A' 3575 ' ' LEU . 23.9 t -115.7 -54.91 4.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 121.387 0.613 . . . . 0.0 110.764 174.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.462 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 68.5 m -160.69 172.01 17.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.786 -171.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3529 ' ' GLY . . . . . 0.457 ' HA2' ' HB3' ' A' 3570 ' ' GLU . . . 89.33 -151.11 21.75 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.298 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.511 ' HB2' ' HA ' ' A' 3571 ' ' THR . 39.7 t30 -108.26 117.6 34.58 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.597 0.237 . . . . 0.0 110.5 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.2 p30 -62.69 -29.14 70.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.4 -176.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3532 ' ' VAL . . . . . 0.431 ' HB ' HD22 ' A' 3530 ' ' ASN . 60.2 t -57.93 -34.75 49.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.37 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3533 ' ' LEU . . . . . . . . . . . . . 34.2 mt -59.11 -46.22 88.88 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.462 ' HA ' HD11 ' A' 3661 ' ' ILE . . . -66.36 -41.34 89.63 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 120.84 0.352 . . . . 0.0 110.474 -177.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -60.43 -39.18 86.51 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.356 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -89.01 -17.74 28.78 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.485 ' HB2' HD12 ' A' 3626 ' ' LEU . 51.0 p -93.28 -41.61 9.78 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.966 -0.459 . . . . 0.0 110.788 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' 3509 ' ' TRP . 21.4 mt -80.56 110.39 16.78 Favored Pre-proline 0 C--N 1.32 -0.677 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 -179.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo . . . . . 0 N--CA 1.456 -0.722 0 C-N-CA 122.554 2.169 . . . . 0.0 112.369 -176.918 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo . . . . . 0 C--O 1.236 0.379 0 N-CA-C 111.616 -0.186 . . . . 0.0 111.616 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.611 ' HB3' HD13 ' A' 3612 ' ' ILE . 19.7 mt -69.04 109.23 3.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.263 177.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.684 ' HA ' ' O ' ' A' 3514 ' ' ALA . 18.5 ptt180 -90.98 144.49 25.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.81 0.338 . . . . 0.0 110.902 -178.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3549 ' ' ILE . . . . . . . . . . . . . 19.6 mt -99.19 110.93 27.48 Favored 'Isoleucine or valine' 0 C--O 1.246 0.874 0 CA-C-O 121.848 0.832 . . . . 0.0 111.12 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.478 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -117.42 5.92 12.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.281 -174.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.663 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 58.9 mt-30 -152.89 170.26 20.79 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.386 0.136 . . . . 0.0 110.935 177.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.713 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -153.18 139.29 18.3 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.744 0.307 . . . . 0.0 111.528 -177.609 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.602 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.7 tmm? -116.88 111.65 19.96 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.839 176.082 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 75.9 mtm-85 -61.07 111.03 1.53 Allowed 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.417 HD11 ' O ' ' A' 3555 ' ' LEU . 1.8 pp -68.53 98.34 0.86 Allowed 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.071 0.939 . . . . 0.0 109.545 -176.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.593 ' O ' ' HG ' ' A' 3560 ' ' LEU . 13.0 mm-40 -109.62 164.35 12.61 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.643 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -53.34 -51.39 62.57 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.884 0.373 . . . . 0.0 111.447 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 21.0 p -65.42 -36.56 84.29 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.982 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.487 ' O ' HG21 ' A' 3563 ' ' VAL . 16.0 mm100 -64.91 -37.83 88.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.753 178.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' 3556 ' ' GLU . 86.4 mt -64.85 -31.33 72.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.648 179.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -67.12 -44.25 80.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.206 0.527 . . . . 0.0 110.098 173.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -56.16 -45.46 87.72 Favored Glycine 0 CA--C 1.518 0.225 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.819 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.557 ' O ' ' HG2' ' A' 3566 ' ' ARG . 60.0 t -62.55 -43.63 98.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 0.0 110.342 176.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -56.8 -39.87 74.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.26 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.6 ' O ' ' HB ' ' A' 3568 ' ' THR . 45.8 ttt180 -58.33 -44.11 88.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.678 0.275 . . . . 0.0 111.469 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3566 ' ' ARG . . . . . 0.557 ' HG2' ' O ' ' A' 3563 ' ' VAL . 5.7 ptp180 -76.69 -20.07 57.0 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.49 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.564 ' HG2' ' CE2' ' A' 3573 ' ' TYR . 81.3 mtp -84.61 -11.74 55.37 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.319 0.581 . . . . 0.0 109.964 175.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3568 ' ' THR . . . . . 0.6 ' HB ' ' O ' ' A' 3565 ' ' ARG . 3.3 m -74.8 -23.93 58.57 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.171 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 60.6 t -126.58 101.27 7.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.257 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3570 ' ' GLU . . . . . 0.457 ' HB3' ' HA2' ' A' 3529 ' ' GLY . 44.9 mt-10 -75.72 109.0 8.95 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.511 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.2 m 148.55 -38.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.646 1.578 . . . . 0.0 107.287 -172.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.85 -27.53 40.12 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.238 176.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.734 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.1 OUTLIER -131.36 164.0 26.63 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.064 176.237 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.6 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 47.7 t -127.74 135.43 50.13 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 171.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.635 HD21 ' CG1' ' A' 3527 ' ' VAL . 13.6 tp -104.67 125.66 51.0 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.521 HD11 HD23 ' A' 3524 ' ' LEU . 64.5 mt -126.18 158.2 36.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.245 0.545 . . . . 0.0 111.217 -176.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.524 ' HG ' HD13 ' A' 3646 ' ' LEU . 0.3 OUTLIER -126.13 107.93 10.86 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.699 178.79 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.485 ' HB2' HD11 ' A' 3659 ' ' ILE . . . -94.83 123.04 38.06 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.251 0.548 . . . . 0.0 110.626 -177.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.405 ' O ' ' HA ' ' A' 3522 ' ' VAL . 83.4 mt -123.02 142.56 38.48 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.299 -179.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.87 112.11 1.4 Allowed 'Trans proline' 0 C--O 1.234 0.312 0 C-N-CA 122.382 2.055 . . . . 0.0 111.835 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3581 ' ' CYS . . . . . 0.535 ' HB3' ' HG2' ' A' 3523 ' ' GLN . 28.9 p -98.7 120.25 38.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.005 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3582 ' ' GLY . . . . . 0.47 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -97.52 142.69 16.29 Favored Glycine 0 N--CA 1.439 -1.111 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.536 -178.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 45.2 mtt85 -66.32 -31.42 72.2 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.037 0.922 . . . . 0.0 109.041 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.563 ' O ' HG23 ' A' 3588 ' ' VAL . 28.7 t70 -144.93 170.04 16.91 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.062 -1.426 . . . . 0.0 107.739 176.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -56.5 -38.11 71.31 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 118.203 0.456 . . . . 0.0 110.347 177.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -61.05 -46.72 89.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.383 0.611 . . . . 0.0 109.765 176.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.58 ' O ' ' HG2' ' A' 3591 ' ' GLN . 6.2 t70 -60.5 -44.75 95.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.173 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' 3584 ' ' ASP . 86.9 t -52.18 -41.37 33.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.104 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3589 ' ' VAL . . . . . 0.439 ' O ' ' HG2' ' A' 3593 ' ' GLU . 3.6 t -63.82 -52.32 58.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.685 0.755 . . . . 0.0 109.399 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 71.6 m -58.22 -43.83 87.91 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.116 -1.402 . . . . 0.0 111.977 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3591 ' ' GLN . . . . . 0.58 ' HG2' ' O ' ' A' 3587 ' ' ASP . 18.1 mm-40 -68.61 -41.31 79.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.038 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 83.2 m -61.45 -52.42 64.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.095 -178.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3593 ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.1 pt-20 -67.23 -32.75 74.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.288 -178.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 28.1 t -64.78 -46.38 82.35 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 176.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.578 HD11 HD11 ' A' 3657 ' ' LEU . 52.0 tp -63.76 -46.2 86.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.231 -178.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.78 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.7 -29.26 69.78 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.493 -175.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 3597 ' ' ALA . . . . . 0.455 ' O ' ' HB ' ' A' 3601 ' ' THR . . . -85.91 -42.38 14.13 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.908 0.385 . . . . 0.0 111.256 179.132 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -85.24 -45.85 11.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -170.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.489 ' HB2' HD12 ' A' 3595 ' ' LEU . 15.1 m-85 -99.34 -50.41 4.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.704 0.288 . . . . 0.0 111.18 -176.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.78 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 26.3 mm -61.38 -55.78 22.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.066 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3601 ' ' THR . . . . . 0.455 ' HB ' ' O ' ' A' 3597 ' ' ALA . 74.4 m -60.43 -38.27 83.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.687 0.28 . . . . 0.0 111.221 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.817 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.0 OUTLIER -67.05 -55.84 12.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.687 178.336 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.817 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.82 -41.98 78.8 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -178.354 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -70.74 -37.81 73.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.594 -177.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.13 -38.53 82.3 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 121.085 0.469 . . . . 0.0 110.626 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3606 ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' 3602 ' ' TYR . 69.6 mmtt -77.5 -19.43 55.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.482 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 49.9 49.94 19.34 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.625 -169.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.431 ' O ' HD11 ' A' 3603 ' ' LEU . . . -128.5 -175.48 3.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.362 0.601 . . . . 0.0 112.169 -171.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.713 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.67 117.82 29.28 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.239 175.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.02 102.55 0.59 Allowed Glycine 0 C--O 1.221 -0.666 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 176.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.663 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.3 mm -89.21 121.4 39.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 121.204 0.526 . . . . 0.0 110.84 -174.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.611 HD13 ' HB3' ' A' 3547 ' ' LEU . 57.6 mt -117.87 105.38 17.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.444 175.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -87.41 115.32 24.74 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.867 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.314 -0.939 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.583 -177.127 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 3624 ' ' TYR . . . . . . . . . . . . . 85.5 m-85 . . . . . 0 CA--C 1.513 -0.477 0 CA-C-O 121.134 0.492 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 4.2 t -124.84 117.27 49.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.003 178.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.618 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -98.17 112.25 24.29 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 170.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.479 ' HB3' ' HB1' ' A' 3609 ' ' ALA . 34.0 mt-30 -94.72 110.47 22.31 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.658 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.578 HG12 HG12 ' A' 3659 ' ' ILE . 38.7 mt -92.14 98.06 7.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.027 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3629 ' ' PHE . . . . . 0.527 ' HB2' ' HE2' ' A' 3658 ' ' MET . 97.5 m-85 -89.78 147.67 38.11 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.764 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.447 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.8 Cg_endo -70.35 171.02 15.91 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.364 2.043 . . . . 0.0 111.134 175.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.37 42.04 0.45 Allowed 'Trans proline' 0 CA--C 1.532 0.425 0 C-N-CA 123.025 2.483 . . . . 0.0 112.603 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.414 ' H ' ' C ' ' A' 3630 ' ' PRO . 24.8 p -72.56 163.36 28.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.151 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -44.95 -47.97 11.37 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 123.721 0.638 . . . . 0.0 110.937 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 26.6 t80 -48.95 -55.43 11.88 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.653 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3635 ' ' SER . . . . . 0.47 ' HA ' ' HE1' ' A' 3658 ' ' MET . 19.7 m -56.58 -58.09 9.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.979 -177.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -60.81 -35.43 76.49 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.388 -174.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 66.4 m -57.34 -61.99 2.09 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.072 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -69.83 -20.36 63.44 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.143 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 62.8 mt -66.03 -35.97 81.99 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.364 174.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.788 ' HA ' HD22 ' A' 3647 ' ' LEU . 15.3 m -69.6 -35.31 75.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.321 0.581 . . . . 0.0 110.467 178.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -81.14 -37.79 28.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.058 -178.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.588 HD13 HD23 ' A' 3575 ' ' LEU . 15.7 mt -89.37 -31.11 17.93 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -174.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.42 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -153.0 72.53 7.11 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -176.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3644 ' ' PRO . . . . . 0.543 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 50.3 Cg_endo -70.87 -17.17 32.73 Favored 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 122.152 1.901 . . . . 0.0 111.856 177.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3645 ' ' ASP . . . . . 0.535 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 40.1 m-20 -72.73 -45.0 60.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.177 -177.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.593 ' HB2' HD13 ' A' 3501 ' ' LEU . 0.1 OUTLIER -83.09 -28.79 29.24 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 176.634 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.788 HD22 ' HA ' ' A' 3640 ' ' SER . 22.4 tp -50.54 -47.05 57.8 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.546 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.15 -19.01 61.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.945 0.402 . . . . 0.0 111.705 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 36.6 m -89.69 -31.05 17.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.839 0.352 . . . . 0.0 110.824 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.527 HG12 ' HA ' ' A' 3647 ' ' LEU . 6.5 pt -85.83 -13.77 10.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.623 -178.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 47.4 m -59.48 -22.17 61.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.795 0.331 . . . . 0.0 111.222 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -88.02 -38.37 15.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.481 0.658 . . . . 0.0 109.758 174.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.548 HD13 ' HG2' ' A' 3655 ' ' PRO . 8.2 tp -105.26 42.4 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 122.288 1.042 . . . . 0.0 109.408 -178.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.482 ' N ' ' HD2' ' A' 3655 ' ' PRO . 42.0 m -40.37 -42.0 2.86 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 114.384 -1.28 . . . . 0.0 113.148 171.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.548 ' HG2' HD13 ' A' 3653 ' ' ILE . 11.2 Cg_endo -58.15 83.45 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.635 1.557 . . . . 0.0 111.404 167.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.0 p-80 -149.26 169.71 20.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.253 -177.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.578 HD11 HD11 ' A' 3595 ' ' LEU . 46.3 mt -117.57 132.83 56.46 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.581 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3658 ' ' MET . . . . . 0.527 ' HE2' ' HB2' ' A' 3629 ' ' PHE . 9.5 tmm? -99.61 109.82 22.3 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 177.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.583 HD11 HD22 ' A' 3524 ' ' LEU . 74.2 mt -107.31 121.48 60.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 121.281 0.562 . . . . 0.0 111.566 -170.152 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.734 HG12 ' HD2' ' A' 3573 ' ' TYR . 91.8 t -104.56 113.8 42.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.727 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.618 HG12 ' HG ' ' A' 3626 ' ' LEU . 58.3 mt -91.02 115.53 30.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.829 177.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -124.47 132.51 53.49 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.834 -0.346 . . . . 0.0 111.622 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 24.7 m -86.03 112.44 21.24 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 171.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.533 -178.65 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.602 ' CD1' ' HB2' ' A' 3553 ' ' MET . 57.0 m-85 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.539 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.6 OUTLIER 56.13 -162.02 0.18 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.829 0.823 . . . . 0.0 111.848 176.69 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 25.7 m -146.32 117.88 8.02 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 114.613 -1.176 . . . . 0.0 108.032 168.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.513 HD21 ' CD1' ' A' 3515 ' ' LEU . 24.4 tp . . . . . 0 N--CA 1.449 -0.505 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.042 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.571 HD11 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp . . . . . 0 C--O 1.233 0.233 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.581 HD11 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.37 -15.56 63.75 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.546 -174.065 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.581 ' N ' HD11 ' A' 3502 ' ' LEU . 13.7 mptt -57.41 -42.64 82.69 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.212 173.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3504 ' ' LYS . . . . . 0.476 ' HB3' ' CD2' ' A' 3505 ' ' TYR . 5.1 tmtm? -95.45 -38.6 10.39 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.731 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -147.06 101.39 3.87 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-O 121.302 0.572 . . . . 0.0 111.629 -177.422 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3506 ' ' PRO . . . . . 0.47 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 91.9 Cg_endo -86.23 174.02 6.38 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 124.158 3.239 . . . . 0.0 113.723 -178.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.473 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 88.2 mt -71.88 131.34 34.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.243 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 29.3 m -100.96 -28.82 3.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.466 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.674 ' HE3' HD13 ' A' 3524 ' ' LEU . 14.0 t90 -153.11 155.05 36.05 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 110.229 -0.285 . . . . 0.0 110.229 -175.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -150.95 119.93 6.67 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.74 -130.52 1.23 Allowed Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 -178.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.609 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -136.87 152.71 50.54 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.359 0.6 . . . . 0.0 111.437 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.464 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 72.6 mt -105.53 153.61 21.51 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 168.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.648 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -146.64 124.07 11.67 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -177.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.826 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.3 144.61 38.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.687 172.674 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.826 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.7 OUTLIER 59.36 -93.56 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 122.964 0.506 . . . . 0.0 110.293 -170.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 20.2 m120 -141.78 7.31 1.86 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.842 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -104.51 129.67 52.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.115 0.484 . . . . 0.0 111.205 -177.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.553 HG21 ' HB1' ' A' 3514 ' ' ALA . 18.0 p -108.96 154.81 21.64 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.509 176.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -143.97 113.49 7.03 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.776 175.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.609 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.52 115.87 10.2 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.115 0.483 . . . . 0.0 110.059 177.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 28.0 m -129.67 147.77 33.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.582 0.706 . . . . 0.0 111.795 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3523 ' ' GLN . . . . . 0.438 ' HG2' ' HB3' ' A' 3581 ' ' CYS . 3.8 pt20 -108.59 125.73 52.16 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.021 -0.99 . . . . 0.0 108.861 172.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.674 HD13 ' HE3' ' A' 3509 ' ' TRP . 0.9 OUTLIER -93.07 111.37 22.98 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.421 0.629 . . . . 0.0 111.716 -175.957 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.473 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 70.2 m-70 -87.65 136.56 32.9 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.878 -1.055 . . . . 0.0 108.595 175.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.731 ' O ' ' HB2' ' A' 3505 ' ' TYR . 63.9 t80 -64.77 141.09 58.89 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.632 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.1 t -115.3 -58.36 3.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 CA-C-O 121.386 0.612 . . . . 0.0 110.64 174.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.497 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 58.3 m -160.74 171.66 18.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.197 -171.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.59 -149.0 20.29 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.516 -0.849 . . . . 0.0 112.609 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.565 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.0 t-20 -101.6 111.54 23.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.599 0.237 . . . . 0.0 110.494 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -61.15 -31.7 71.42 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.589 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 23.6 t -63.16 -32.3 55.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.508 -178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.541 HD22 ' HD3' ' A' 3536 ' ' ARG . 28.8 mt -57.59 -39.44 76.81 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.086 177.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.456 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -67.38 -46.85 72.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.921 0.391 . . . . 0.0 110.297 179.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -63.58 -27.66 69.4 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.286 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3536 ' ' ARG . . . . . 0.541 ' HD3' HD22 ' A' 3533 ' ' LEU . 12.8 ptm180 -90.32 -14.92 32.18 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.468 ' O ' HG21 ' A' 3614 ' ' VAL . 21.7 p -103.78 -38.23 7.14 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.854 0.359 . . . . 0.0 111.949 -179.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.544 HD11 ' HB2' ' A' 3509 ' ' TRP . 19.4 mt -79.98 121.04 81.63 Favored Pre-proline 0 C--N 1.317 -0.815 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -175.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 6.6 Cg_endo . . . . . 0 N--CA 1.456 -0.708 0 C-N-CA 122.592 2.194 . . . . 0.0 113.667 -173.539 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo . . . . . 0 N--CA 1.46 -0.446 0 CA-C-O 120.859 0.275 . . . . 0.0 112.018 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.546 ' HB3' HD12 ' A' 3612 ' ' ILE . 56.6 mt -74.09 112.25 10.04 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.932 177.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.648 ' HA ' ' O ' ' A' 3514 ' ' ALA . 16.2 ptt-85 -103.16 142.52 34.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.149 0.499 . . . . 0.0 111.003 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.491 ' CG2' HD11 ' B' 2521 ' ' LEU . 33.2 mt -95.86 108.76 21.58 Favored 'Isoleucine or valine' 0 C--O 1.245 0.855 0 CA-C-O 121.878 0.847 . . . . 0.0 112.016 -171.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.447 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.3 -1.28 15.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.966 -176.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.636 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 41.6 mt-30 -149.95 170.66 18.31 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.423 0.154 . . . . 0.0 111.038 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.715 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.14 141.21 17.34 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.934 0.397 . . . . 0.0 111.193 -179.68 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.591 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -110.6 121.39 45.2 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.402 178.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -63.34 110.68 1.99 Allowed 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.603 HD11 ' O ' ' A' 3555 ' ' LEU . 3.2 pp -70.16 99.54 1.51 Allowed 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 122.152 0.977 . . . . 0.0 109.791 -178.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.587 ' O ' ' HG ' ' A' 3560 ' ' LEU . 38.5 mt-10 -112.91 160.08 18.42 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.634 -1.166 . . . . 0.0 109.659 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.6 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -52.53 -52.36 55.12 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.414 0.446 . . . . 0.0 111.202 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 7.0 p -58.85 -42.38 89.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.42 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.531 ' O ' HG21 ' A' 3563 ' ' VAL . 23.2 mm-40 -62.1 -48.07 81.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.035 177.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' 3556 ' ' GLU . 87.0 mt -61.05 -34.46 74.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.404 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' A' 3557 ' ' ALA . 29.6 mm-40 -59.38 -51.89 67.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.174 0.511 . . . . 0.0 109.878 175.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.31 -38.89 96.44 Favored Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.312 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.54 ' O ' ' HG3' ' A' 3567 ' ' MET . 83.9 t -61.24 -56.39 18.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.535 0.207 . . . . 0.0 110.644 178.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -65.23 -29.03 69.79 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -175.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.401 ' NH1' ' HB3' ' A' 3561 ' ' GLU . 72.2 mtt180 -75.9 -22.83 55.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3566 ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' 3563 ' ' VAL . 36.4 ptt180 -89.49 -12.32 40.4 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.669 169.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.54 ' HG3' ' O ' ' A' 3563 ' ' VAL . 78.1 mtp -81.72 -19.06 42.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.785 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 21.8 p -75.09 -19.23 60.06 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.408 0.623 . . . . 0.0 110.081 176.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.7 t -95.93 79.52 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.002 177.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.65 108.41 2.89 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.565 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 153.44 -43.24 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.52 1.528 . . . . 0.0 108.053 -175.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.25 -30.65 34.05 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.832 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.704 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -125.69 165.31 18.83 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.172 -179.891 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.583 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 25.4 t -127.09 135.79 51.25 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 171.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.632 HD23 ' CG1' ' A' 3527 ' ' VAL . 13.9 tp -106.16 125.17 50.66 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 178.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.539 HD13 HD23 ' A' 3524 ' ' LEU . 79.1 mt -127.19 151.78 48.24 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.149 0.499 . . . . 0.0 110.755 -177.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.683 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.03 108.68 14.59 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.473 ' HB3' HD13 ' A' 3659 ' ' ILE . . . -94.39 122.4 36.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.304 0.573 . . . . 0.0 110.431 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.586 HD21 HG22 ' A' 3650 ' ' ILE . 82.5 mt -122.13 140.83 33.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.184 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.88 112.72 1.44 Allowed 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.393 2.062 . . . . 0.0 111.819 178.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3581 ' ' CYS . . . . . 0.438 ' HB3' ' HG2' ' A' 3523 ' ' GLN . 25.7 p -99.75 118.47 36.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.116 0.484 . . . . 0.0 110.293 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3582 ' ' GLY . . . . . 0.43 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.33 145.57 16.26 Favored Glycine 0 N--CA 1.442 -0.948 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.652 -178.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -76.87 -31.23 56.66 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.907 0.86 . . . . 0.0 109.353 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.478 ' H ' ' HB3' ' A' 3587 ' ' ASP . 22.8 t70 -134.47 167.66 20.36 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.346 -178.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -54.6 -43.55 72.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.005 0.431 . . . . 0.0 110.348 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.32 -33.68 71.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.176 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.478 ' HB3' ' H ' ' A' 3584 ' ' ASP . 6.8 t70 -64.93 -42.77 94.39 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.468 HG22 ' O ' ' A' 3584 ' ' ASP . 93.8 t -56.28 -50.96 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.202 176.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 75.1 t -58.21 -50.51 78.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.695 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 42.1 t -55.43 -51.12 67.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.319 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -65.73 -36.98 85.13 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 121.22 -0.192 . . . . 0.0 111.225 -177.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3592 ' ' THR . . . . . 0.435 ' O ' ' HB3' ' A' 3596 ' ' LYS . 49.2 m -64.41 -44.71 90.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.957 0.408 . . . . 0.0 110.181 176.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3593 ' ' GLU . . . . . 0.443 ' HA ' ' CE ' ' A' 3596 ' ' LYS . 12.9 tp10 -61.01 -47.16 87.73 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.604 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 39.4 m -65.85 -47.72 73.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.047 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.563 HD11 HD13 ' A' 3657 ' ' LEU . 59.6 tp -59.5 -44.15 93.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.87 0.367 . . . . 0.0 110.73 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.692 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.9 OUTLIER -62.59 -35.76 80.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.262 -178.033 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3597 ' ' ALA . . . . . 0.41 ' O ' ' HB ' ' A' 3601 ' ' THR . . . -83.59 -41.18 18.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.728 0.299 . . . . 0.0 111.725 -178.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.483 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -86.57 -46.27 10.29 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -170.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.496 ' HB2' HD13 ' A' 3595 ' ' LEU . 19.6 m-85 -99.45 -50.5 4.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.711 0.291 . . . . 0.0 111.166 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.692 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.2 mm -60.88 -57.01 14.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.664 -176.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3601 ' ' THR . . . . . 0.41 ' HB ' ' O ' ' A' 3597 ' ' ALA . 91.7 m -56.29 -49.11 75.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.022 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.694 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.1 OUTLIER -59.52 -57.33 13.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.158 -179.489 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.694 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.3 OUTLIER -55.83 -42.28 75.49 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -178.52 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -75.85 -40.03 55.49 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.848 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -66.1 -46.43 77.64 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.988 0.423 . . . . 0.0 110.97 -178.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -77.74 -11.59 59.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.281 -178.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 50.36 63.22 2.29 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.255 -174.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.505 ' O ' HD12 ' A' 3603 ' ' LEU . . . -138.35 -176.28 4.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.213 0.53 . . . . 0.0 112.317 -173.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.715 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -122.89 117.78 26.37 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.33 174.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3610 ' ' GLY . . . . . 0.451 ' N ' HD13 ' A' 3603 ' ' LEU . . . -64.36 103.7 0.78 Allowed Glycine 0 C--O 1.222 -0.621 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.499 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.636 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.8 mm -89.42 124.33 42.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 121.212 0.53 . . . . 0.0 110.659 -175.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.546 HD12 ' HB3' ' A' 3547 ' ' LEU . 62.1 mt -124.2 105.99 16.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.108 177.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.507 ' HA ' ' O ' ' A' 3624 ' ' TYR . 7.1 m120 -80.77 112.31 18.03 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.468 HG21 ' O ' ' A' 3537 ' ' SER . 6.2 p . . . . . 0 C--N 1.311 -1.068 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.815 -177.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.507 ' O ' ' HA ' ' A' 3613 ' ' ASN . 78.7 m-85 . . . . . 0 C--O 1.239 0.521 0 CA-C-O 120.691 0.282 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 20.1 t -116.1 114.98 47.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.935 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.586 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -99.45 115.44 29.28 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 168.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.48 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 97.9 mt-30 -94.66 111.32 23.09 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.04 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.583 HG12 HG12 ' A' 3659 ' ' ILE . 43.9 mt -90.46 98.46 8.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.961 178.096 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -88.48 145.04 34.66 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.085 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.548 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.3 Cg_endo -69.91 172.84 12.04 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.744 2.296 . . . . 0.0 111.901 177.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -70.88 46.69 0.66 Allowed 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 122.97 2.447 . . . . 0.0 112.272 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.5 p -80.66 162.63 24.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.276 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -53.73 -38.96 64.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.012 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 32.0 t80 -49.69 -50.04 45.26 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 121.284 0.564 . . . . 0.0 110.95 174.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 4.1 m -64.95 -52.9 53.77 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.153 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -52.19 -50.65 61.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.143 -176.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 51.3 p -60.56 -50.45 73.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.174 0.512 . . . . 0.0 110.711 -175.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 72.1 m80 -66.3 -36.24 82.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.975 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 76.4 mt -64.29 -34.67 78.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.052 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.969 ' HA ' HD23 ' A' 3647 ' ' LEU . 34.8 m -64.12 -37.1 86.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.224 0.535 . . . . 0.0 110.412 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.82 -51.11 9.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.202 178.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.581 HD12 HD21 ' A' 3575 ' ' LEU . 30.1 mt -72.45 -34.39 67.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.789 -171.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.425 ' HB2' ' CZ ' ' A' 3505 ' ' TYR . . . -151.35 84.39 5.22 Favored Pre-proline 0 C--N 1.328 -0.334 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -73.52 -23.12 17.56 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.6 2.2 . . . . 0.0 113.372 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 12.3 t0 -76.46 -52.91 8.91 Favored 'General case' 0 CA--C 1.515 -0.365 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 -175.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.683 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -69.79 -28.32 65.64 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 178.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.969 HD23 ' HA ' ' A' 3640 ' ' SER . 31.7 tp -51.12 -50.13 59.45 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.914 174.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.33 -23.75 65.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.179 -178.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 12.9 m -83.43 -36.38 24.26 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.436 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.586 HG22 HD21 ' A' 3579 ' ' LEU . 4.3 pt -81.31 -17.28 12.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.487 -177.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 49.6 m -58.44 -22.55 54.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.91 175.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3652 ' ' ASN . . . . . 0.41 ' N ' HD21 ' A' 3652 ' ' ASN . 0.9 OUTLIER -89.28 -37.09 15.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.016 0.436 . . . . 0.0 110.787 174.454 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.501 HG21 ' HA ' ' A' 3650 ' ' ILE . 7.5 tp -104.51 39.76 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 122.473 1.13 . . . . 0.0 109.307 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.461 ' N ' ' HD2' ' A' 3655 ' ' PRO . 20.2 m -35.53 -44.57 0.84 Allowed Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 113.784 -1.553 . . . . 0.0 114.038 173.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' 3654 ' ' SER . 20.2 Cg_endo -62.46 76.12 0.1 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.541 1.494 . . . . 0.0 112.008 171.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 34.6 p80 -145.65 175.47 10.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.121 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.563 HD13 HD11 ' A' 3595 ' ' LEU . 21.6 mt -120.6 152.32 38.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.77 -177.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 57.4 ttp -112.0 109.51 19.31 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.583 HG12 HG12 ' A' 3628 ' ' ILE . 81.1 mt -102.67 116.63 46.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 121.317 0.58 . . . . 0.0 111.325 -172.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.704 HG13 ' HD2' ' A' 3573 ' ' TYR . 82.1 t -102.47 115.28 44.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.023 -178.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.586 HG12 ' HG ' ' A' 3626 ' ' LEU . 64.3 mt -90.9 121.85 41.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -123.68 126.54 46.75 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.722 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.5 m -104.93 110.47 22.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.832 169.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.03 -178.276 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.591 ' CD1' ' HB2' ' A' 3553 ' ' MET . 31.9 m-85 . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.485 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.5 OUTLIER 54.22 -162.97 0.12 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 122.022 0.915 . . . . 0.0 112.16 177.318 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 1.2 p -144.25 116.72 8.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.096 -1.411 . . . . 0.0 108.225 167.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.502 ' HG ' ' OH ' ' A' 3602 ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.495 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.1 pp . . . . . 0 N--CA 1.453 -0.307 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.629 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.76 -17.32 64.5 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.436 -174.107 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.629 ' N ' HD12 ' A' 3502 ' ' LEU . 22.8 tptm -68.42 -28.15 66.82 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.065 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 32.0 tptt -103.17 -42.29 5.81 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.257 0.551 . . . . 0.0 109.894 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.73 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -146.26 97.16 4.45 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.553 -178.219 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -79.67 173.06 13.44 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.573 2.848 . . . . 0.0 113.524 -176.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.523 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.0 mt -73.0 137.2 23.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.132 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3508 ' ' VAL . . . . . 0.411 HG12 ' HB2' ' A' 3526 ' ' PHE . 27.5 m -105.11 -31.37 2.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.654 -178.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.697 ' HE3' HD13 ' A' 3524 ' ' LEU . 18.2 t90 -145.33 155.69 43.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.793 0.33 . . . . 0.0 110.825 -174.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -150.56 120.6 7.19 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 176.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -174.18 -132.32 1.53 Allowed Glycine 0 N--CA 1.444 -0.818 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -178.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.601 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.4 mp -138.1 155.69 48.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.058 0.456 . . . . 0.0 110.989 178.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.5 HD21 ' HB2' ' A' 3547 ' ' LEU . 91.2 mt -109.03 146.15 34.41 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 169.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.699 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.37 126.84 16.82 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.465 0.174 . . . . 0.0 110.918 -179.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.802 HD13 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.53 141.4 39.32 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 172.619 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.802 ' CD ' HD13 ' A' 3515 ' ' LEU . 0.5 OUTLIER 62.85 -86.99 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.196 0.598 . . . . 0.0 109.908 -171.532 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 2.5 m120 -149.81 11.9 0.76 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.185 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' 3514 ' ' ALA . 16.5 m-20 -103.0 139.4 38.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.358 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.474 HG22 ' HB1' ' A' 3514 ' ' ALA . 37.5 p -127.12 143.13 51.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.108 0.48 . . . . 0.0 111.71 -175.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -139.55 114.69 9.65 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.396 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.586 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -68.97 120.61 15.11 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 177.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.435 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 31.4 m -129.87 148.28 33.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 121.582 0.706 . . . . 0.0 112.181 -174.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -108.72 125.52 52.0 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 114.849 -1.068 . . . . 0.0 108.827 171.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.697 HD13 ' HE3' ' A' 3509 ' ' TRP . 2.1 mt -93.98 114.2 26.35 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.371 0.605 . . . . 0.0 111.637 -176.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.523 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 48.3 m80 -89.5 142.4 27.7 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.747 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.73 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.1 t80 -70.32 135.28 48.73 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 171.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.634 ' CG1' HD22 ' A' 3575 ' ' LEU . 24.3 t -114.33 -57.0 3.99 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-O 121.467 0.651 . . . . 0.0 110.283 176.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.567 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 66.1 m -160.0 171.21 19.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.111 -172.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 86.3 -152.57 25.61 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.432 -0.89 . . . . 0.0 111.744 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.552 ' HB2' ' HA ' ' A' 3571 ' ' THR . 3.4 t-20 -102.13 117.76 35.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.115 0.458 . . . . 0.0 110.758 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -65.24 -28.56 69.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.176 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 61.0 t -59.52 -33.13 50.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.477 178.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.527 HD21 ' HD3' ' A' 3536 ' ' ARG . 18.7 mt -58.94 -41.55 87.64 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.092 177.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.407 ' HB1' ' CD1' ' A' 3538 ' ' LEU . . . -69.23 -40.0 78.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.935 0.397 . . . . 0.0 110.361 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -65.45 -32.68 74.42 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.76 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3536 ' ' ARG . . . . . 0.527 ' HD3' HD21 ' A' 3533 ' ' LEU . 11.2 ptm180 -90.13 -11.63 40.64 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3537 ' ' SER . . . . . . . . . . . . . 26.7 p -104.12 -43.33 5.28 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.542 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.568 HD12 ' HB2' ' A' 3509 ' ' TRP . 35.8 mt -78.82 111.94 23.45 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-O 121.228 0.537 . . . . 0.0 110.033 -172.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3539 ' ' PRO . . . . . 0.504 ' HD3' HG21 ' A' 3614 ' ' VAL . 97.3 Cg_endo . . . . . 0 N--CA 1.453 -0.891 0 C-N-CA 123.101 2.534 . . . . 0.0 112.793 -172.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3546 ' ' PRO . . . . . 0.601 ' HA ' ' O ' ' A' 3512 ' ' LEU . 19.6 Cg_endo . . . . . 0 N--CA 1.453 -0.872 0 N-CA-C 113.455 0.521 . . . . 0.0 113.455 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.587 ' HB3' HD13 ' A' 3612 ' ' ILE . 26.7 mt -79.32 122.98 27.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.637 172.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.699 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -102.84 143.85 31.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 111.816 -174.571 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.519 ' CG2' HD11 ' B' 2521 ' ' LEU . 21.8 mt -98.93 107.45 20.52 Favored 'Isoleucine or valine' 0 C--O 1.248 0.978 0 CA-C-O 122.251 1.024 . . . . 0.0 111.903 -174.055 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.49 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -114.79 1.96 14.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.972 -174.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.667 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 66.8 mt-30 -148.99 172.47 14.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.476 0.179 . . . . 0.0 111.209 178.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.734 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.75 139.91 15.53 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.082 0.468 . . . . 0.0 111.621 -179.273 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.54 ' HB3' ' HB2' ' A' 3609 ' ' ALA . 19.4 ttt -108.17 125.46 51.65 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.352 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -64.0 111.25 2.43 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 177.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.559 HD11 ' O ' ' A' 3555 ' ' LEU . 3.2 pp -76.57 98.56 4.71 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 122.413 1.102 . . . . 0.0 109.476 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' A' 3560 ' ' LEU . 44.1 mt-10 -108.22 159.06 16.91 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.29 176.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -58.64 -41.69 86.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.473 0.654 . . . . 0.0 109.277 175.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3558 ' ' THR . . . . . 0.418 ' O ' ' HB2' ' A' 3561 ' ' GLU . 0.7 OUTLIER -62.27 -41.23 98.28 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.827 177.882 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.523 ' O ' HG22 ' A' 3563 ' ' VAL . 17.2 mm-40 -70.28 -41.53 73.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.698 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' 3556 ' ' GLU . 85.4 mt -61.58 -35.31 77.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.501 178.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' 3558 ' ' THR . 45.2 mm-40 -55.28 -51.35 66.94 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.136 172.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.37 -44.39 98.11 Favored Glycine 0 CA--C 1.519 0.29 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.432 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.523 HG22 ' O ' ' A' 3559 ' ' GLN . 57.3 t -59.54 -52.43 61.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.503 0.192 . . . . 0.0 110.616 179.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3564 ' ' ALA . . . . . 0.53 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.96 -32.25 71.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.026 0.441 . . . . 0.0 111.046 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.47 ' O ' HG23 ' A' 3568 ' ' THR . 41.8 ttp180 -63.06 -38.27 90.52 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.167 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 25.2 ptt180 -88.5 -10.86 47.54 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.899 -0.32 . . . . 0.0 111.282 175.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.53 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 65.0 mtp -80.14 -26.55 39.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.975 177.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3568 ' ' THR . . . . . 0.47 HG23 ' O ' ' A' 3565 ' ' ARG . 8.5 t -74.73 -9.43 58.55 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.983 0.42 . . . . 0.0 110.834 -177.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 40.8 t -111.26 87.63 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.302 0.572 . . . . 0.0 110.236 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.15 110.42 4.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.178 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.552 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.6 m 150.94 -40.62 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.747 1.619 . . . . 0.0 107.825 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -80.69 -30.83 36.41 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.629 -179.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.655 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.2 OUTLIER -126.72 166.5 17.28 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.058 178.626 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.582 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 33.7 t -129.27 135.81 49.26 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 171.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.634 HD22 ' CG1' ' A' 3527 ' ' VAL . 9.4 tp -105.87 124.8 50.15 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 177.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.497 HD13 HD22 ' A' 3524 ' ' LEU . 80.9 mt -125.1 158.1 34.67 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.038 0.447 . . . . 0.0 110.888 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.736 ' HG ' HD13 ' A' 3646 ' ' LEU . 0.3 OUTLIER -125.74 106.9 10.04 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.391 -179.365 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.49 ' HB1' HD11 ' A' 3659 ' ' ILE . . . -94.61 123.64 38.17 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.324 0.583 . . . . 0.0 110.605 -177.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.445 HD21 ' HB2' ' A' 3656 ' ' HIS . 39.5 mt -126.42 145.05 51.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 114.706 -1.133 . . . . 0.0 109.912 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.23 111.38 0.99 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 122.323 2.016 . . . . 0.0 112.079 177.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.1 p -96.5 113.22 24.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.16 0.505 . . . . 0.0 109.975 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3582 ' ' GLY . . . . . 0.45 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -96.36 146.15 18.13 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.111 -175.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -73.31 -15.48 61.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.935 0.874 . . . . 0.0 109.417 177.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.625 ' O ' HG22 ' A' 3588 ' ' VAL . 16.7 t70 -158.35 167.03 30.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.113 -1.403 . . . . 0.0 107.22 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -58.62 -40.9 84.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 118.144 0.429 . . . . 0.0 110.47 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.51 -37.23 86.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.513 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' 3591 ' ' GLN . 17.1 t70 -63.45 -44.26 95.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.769 178.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.625 HG22 ' O ' ' A' 3584 ' ' ASP . 58.1 t -54.1 -42.52 55.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.727 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 5.4 t -62.75 -49.27 84.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.629 0.728 . . . . 0.0 109.571 -178.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 55.8 m -62.74 -39.9 95.53 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.765 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3591 ' ' GLN . . . . . 0.489 HE21 ' HB2' ' A' 3521 ' ' ALA . 13.7 mm100 -70.56 -39.48 73.92 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.358 -0.214 . . . . 0.0 110.972 179.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 73.8 m -60.14 -50.32 74.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.842 0.353 . . . . 0.0 111.157 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3593 ' ' GLU . . . . . 0.518 ' HA ' ' HG2' ' A' 3596 ' ' LYS . 11.4 pt-20 -66.76 -30.89 71.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.166 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 50.5 m -70.54 -40.47 73.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.089 0.471 . . . . 0.0 110.219 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.558 HD13 HD12 ' A' 3657 ' ' LEU . 59.5 tp -65.61 -46.16 80.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.09 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.782 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 19.9 ptmt -65.65 -34.39 78.11 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.256 -178.09 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -78.17 -39.19 41.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.671 0.272 . . . . 0.0 111.393 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.476 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -91.05 -46.26 8.23 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -172.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.481 ' HB2' HD11 ' A' 3595 ' ' LEU . 19.1 m-85 -99.01 -50.37 4.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.774 0.321 . . . . 0.0 111.533 -174.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.782 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 23.2 mm -61.91 -58.13 8.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.067 -175.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 87.7 m -57.55 -42.54 83.19 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.147 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.824 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -62.43 -57.37 11.5 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 121.366 -0.133 . . . . 0.0 110.979 178.325 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.824 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.1 OUTLIER -57.13 -39.2 74.69 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.58 0.229 . . . . 0.0 111.466 -176.322 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -77.53 -38.13 49.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.748 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.74 -35.56 75.08 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.966 0.413 . . . . 0.0 111.129 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3606 ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' 3602 ' ' TYR . 27.1 mmmt -87.71 -9.09 55.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.931 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 47.33 63.45 1.97 Allowed 'General case' 0 C--O 1.235 0.328 0 O-C-N 123.764 0.665 . . . . 0.0 111.266 -177.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.485 ' HB1' ' HB2' ' A' 3552 ' ' ARG . . . -143.23 -177.42 5.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.009 -0.541 . . . . 0.0 112.027 -175.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.734 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -116.04 118.25 32.37 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.164 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3610 ' ' GLY . . . . . 0.451 ' N ' HD13 ' A' 3603 ' ' LEU . . . -63.07 102.73 0.55 Allowed Glycine 0 C--O 1.223 -0.547 0 C-N-CA 120.718 -0.753 . . . . 0.0 111.343 178.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.667 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.6 mm -89.55 123.84 41.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.238 0.542 . . . . 0.0 110.795 -175.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.587 HD13 ' HB3' ' A' 3547 ' ' LEU . 53.8 mt -119.23 106.79 19.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.739 175.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.445 ' HA ' ' O ' ' A' 3624 ' ' TYR . 4.1 m120 -82.97 106.85 15.14 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 175.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.504 HG21 ' HD3' ' A' 3539 ' ' PRO . 9.3 p . . . . . 0 C--N 1.312 -1.058 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.143 -171.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.445 ' O ' ' HA ' ' A' 3613 ' ' ASN . 79.0 m-85 . . . . . 0 C--O 1.236 0.363 0 CA-C-O 121.061 0.458 . . . . 0.0 110.52 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.448 HG12 HD12 ' A' 3611 ' ' ILE . 15.5 t -113.39 114.28 46.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.972 176.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.608 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.4 mp -100.41 113.44 26.2 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.471 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 14.3 mt-30 -94.68 110.38 22.22 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.647 -178.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.584 HG12 HG12 ' A' 3659 ' ' ILE . 40.5 mt -91.82 98.19 8.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.072 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -88.58 141.71 30.49 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.297 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.644 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 57.2 Cg_endo -71.31 164.6 35.2 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.572 2.182 . . . . 0.0 111.504 176.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3631 ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' 3656 ' ' HIS . 44.3 Cg_endo -67.26 85.86 0.33 Allowed 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.799 2.333 . . . . 0.0 112.016 178.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.542 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.1 p -112.4 162.12 15.92 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.002 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -55.74 -33.78 64.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.684 0.278 . . . . 0.0 110.305 179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.97 -42.58 80.65 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.084 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3635 ' ' SER . . . . . 0.452 ' O ' ' HG ' ' A' 3639 ' ' LEU . 58.7 p -65.32 -52.55 53.22 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.105 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3636 ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' 3632 ' ' CYS . 5.6 mm-40 -63.68 -35.53 80.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.402 -175.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 14.3 p -64.56 -54.69 28.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.606 -176.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -71.34 -19.47 62.29 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 118.871 -1.132 . . . . 0.0 110.733 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3639 ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' 3635 ' ' SER . 41.9 mt -64.9 -35.84 82.44 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.23 172.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.512 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 18.1 m -70.31 -31.83 69.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.423 0.63 . . . . 0.0 109.941 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -76.06 -43.92 41.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.849 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.572 HD11 HD21 ' A' 3575 ' ' LEU . 17.9 mt -85.21 -38.96 18.34 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.512 -0.767 . . . . 0.0 112.753 -172.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.463 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -147.85 82.92 7.66 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.899 0.381 . . . . 0.0 111.556 -177.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.59 -28.06 21.74 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.069 2.513 . . . . 0.0 113.882 -174.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 4.2 t0 -77.73 -37.93 48.19 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.33 -172.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.736 HD13 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -80.03 -31.17 39.57 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 175.184 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.514 ' HA ' HG12 ' A' 3650 ' ' ILE . 3.3 tm? -54.04 -43.69 70.39 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.452 177.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -62.05 -25.76 67.87 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.382 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 73.3 m -78.92 -40.23 32.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.026 0.441 . . . . 0.0 110.598 176.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.633 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.8 pt -82.79 -18.32 10.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.818 -172.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.9 t -59.08 -25.69 63.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -88.84 -35.0 16.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.919 0.39 . . . . 0.0 110.617 174.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.633 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.4 OUTLIER -98.84 30.97 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 122.81 1.291 . . . . 0.0 109.083 -175.56 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.427 ' N ' ' HD2' ' A' 3655 ' ' PRO . 18.7 m -30.03 -42.88 0.2 Allowed Pre-proline 0 CA--C 1.542 0.657 0 CA-C-N 113.763 -1.562 . . . . 0.0 114.851 173.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.429 ' HG2' HD11 ' A' 3653 ' ' ILE . 15.9 Cg_endo -60.55 65.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.849 1.699 . . . . 0.0 112.345 168.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3656 ' ' HIS . . . . . 0.445 ' HB2' HD21 ' A' 3579 ' ' LEU . 23.6 p80 -136.37 174.15 10.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.866 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.558 HD12 HD13 ' A' 3595 ' ' LEU . 31.6 mt -119.93 149.12 42.63 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.765 0.317 . . . . 0.0 110.853 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 51.8 ttp -112.88 110.94 21.35 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.584 HG12 HG12 ' A' 3628 ' ' ILE . 71.0 mt -105.63 118.35 52.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.153 0.501 . . . . 0.0 111.42 -172.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.655 HG12 ' HD2' ' A' 3573 ' ' TYR . 77.2 t -103.18 116.76 47.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.805 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.608 HG12 ' HG ' ' A' 3626 ' ' LEU . 59.1 mt -90.95 114.98 29.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.11 127.94 56.35 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.852 0.358 . . . . 0.0 111.443 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 8.5 m -70.1 137.94 51.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.831 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.518 179.154 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.488 ' CD1' ' HB2' ' A' 3553 ' ' MET . 38.1 m-85 . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' 3551 ' ' GLN . 1.3 tp10 55.29 -160.81 0.17 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.139 0.495 . . . . 0.0 110.897 175.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 7.7 p -144.2 129.9 19.19 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 167.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.519 HD11 ' CG2' ' A' 3549 ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.454 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.509 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp . . . . . 0 N--CA 1.458 -0.073 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.765 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -73.12 -15.53 61.48 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.098 -0.641 . . . . 0.0 110.477 -174.202 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.576 ' N ' HD11 ' A' 3502 ' ' LEU . 55.5 tptt -68.13 -28.33 67.22 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 175.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3504 ' ' LYS . . . . . 0.434 ' HB3' ' CE2' ' A' 3505 ' ' TYR . 4.3 mmmm -92.26 -42.96 9.55 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.776 175.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.718 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -153.5 108.6 2.57 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.812 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3506 ' ' PRO . . . . . 0.765 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 94.0 Cg_endo -87.49 173.55 5.38 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 124.127 3.218 . . . . 0.0 114.025 -175.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.423 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.3 mt -72.11 132.71 33.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.61 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3508 ' ' VAL . . . . . 0.428 HG12 ' HB2' ' A' 3526 ' ' PHE . 31.0 m -103.4 -31.15 2.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.596 -177.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.701 ' HE3' HD12 ' A' 3524 ' ' LEU . 47.3 t90 -147.56 153.64 39.7 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -175.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3510 ' ' GLN . . . . . 0.459 ' HG3' ' HB3' ' A' 3523 ' ' GLN . 21.7 tt0 -151.25 120.01 6.57 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -176.13 -123.29 0.76 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.657 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.5 mp -141.04 157.12 45.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.059 0.457 . . . . 0.0 111.059 179.156 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.437 HD23 ' HB2' ' A' 3547 ' ' LEU . 92.3 mt -108.91 151.29 26.48 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 168.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.727 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -147.65 126.92 13.02 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.74 0.305 . . . . 0.0 111.465 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.829 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.28 141.84 41.95 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 172.914 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.829 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.6 OUTLIER 63.6 -92.12 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -169.446 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 11.5 m120 -147.22 15.1 1.15 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 172.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.48 ' O ' ' HA ' ' A' 3514 ' ' ALA . 4.9 m-20 -96.02 123.26 39.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.361 -176.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.422 HG21 ' HB3' ' A' 3514 ' ' ALA . 37.0 p -113.75 138.77 49.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.074 0.464 . . . . 0.0 111.63 -177.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.97 116.11 14.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.473 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.613 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.73 122.94 20.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.97 0.414 . . . . 0.0 110.333 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' 3579 ' ' LEU . 35.2 m -132.43 149.03 31.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.915 -175.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3523 ' ' GLN . . . . . 0.459 ' HB3' ' HG3' ' A' 3510 ' ' GLN . 11.2 pt20 -112.45 127.59 56.08 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 170.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.701 HD12 ' HE3' ' A' 3509 ' ' TRP . 1.2 mt -95.35 113.3 24.95 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.039 -174.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.423 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 80.2 m-70 -88.0 136.31 33.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.714 175.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.718 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.1 t80 -67.67 139.55 56.78 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 174.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.615 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.5 t -115.1 -58.11 3.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 121.387 0.613 . . . . 0.0 110.979 176.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.431 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 65.0 m -159.69 171.91 18.7 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.275 -171.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.36 -152.02 23.11 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.632 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.581 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.6 t-20 -100.24 112.89 25.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.843 0.354 . . . . 0.0 110.608 -178.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -64.67 -32.08 73.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.495 -176.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 39.9 t -59.47 -32.37 48.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.42 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.441 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 20.3 mt -58.42 -45.81 87.69 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.775 176.12 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -66.6 -40.84 89.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.112 0.482 . . . . 0.0 110.076 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 14.7 t60 -57.57 -41.73 81.68 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.707 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -89.19 -14.32 36.32 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -176.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.45 ' O ' HG23 ' A' 3614 ' ' VAL . 42.4 p -96.81 -39.25 9.52 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 121.981 -0.449 . . . . 0.0 111.617 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.572 HD11 ' HB2' ' A' 3509 ' ' TRP . 31.1 mt -80.43 108.65 10.21 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-O 120.926 0.393 . . . . 0.0 109.978 -175.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo . . . . . 0 N--CA 1.459 -0.547 0 C-N-CA 122.854 2.369 . . . . 0.0 113.06 -171.902 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A 3546 ' ' PRO . . . . . 0.657 ' HA ' ' O ' ' A' 3512 ' ' LEU . 34.8 Cg_endo . . . . . 0 CA--C 1.529 0.266 0 N-CA-C 113.439 0.515 . . . . 0.0 113.439 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.605 ' HB3' HD12 ' A' 3612 ' ' ILE . 29.1 mt -69.24 124.18 23.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.84 173.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.727 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -105.05 142.49 34.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.782 0.325 . . . . 0.0 111.773 -173.903 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.517 ' CG2' HD12 ' B' 2521 ' ' LEU . 34.9 mt -98.89 107.03 19.76 Favored 'Isoleucine or valine' 0 C--O 1.254 1.298 0 CA-C-O 122.608 1.194 . . . . 0.0 112.069 -172.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -107.34 -9.04 16.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.614 -1.175 . . . . 0.0 111.949 -173.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.618 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 58.8 mt-30 -146.29 175.2 10.7 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.951 -0.113 . . . . 0.0 110.859 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.68 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.32 137.0 13.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.87 0.367 . . . . 0.0 111.353 -179.558 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.558 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.6 tmm? -108.17 113.79 27.19 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.174 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3554 ' ' ARG . . . . . 0.504 ' O ' ' HG3' ' A' 3556 ' ' GLU . 14.1 mmt180 -62.52 110.34 1.66 Allowed 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 175.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.489 HD11 ' O ' ' A' 3555 ' ' LEU . 2.3 pp -68.29 97.96 0.78 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.304 1.05 . . . . 0.0 109.809 -173.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.61 ' O ' ' HG ' ' A' 3560 ' ' LEU . 41.5 mt-10 -95.34 154.41 17.21 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.256 -1.338 . . . . 0.0 109.482 -178.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.601 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.49 -42.68 74.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.22 0.534 . . . . 0.0 109.725 174.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 19.3 m -63.26 -41.5 99.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.945 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.573 ' O ' HG21 ' A' 3563 ' ' VAL . 27.7 mm-40 -62.97 -48.34 79.29 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.435 177.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' 3556 ' ' GLU . 69.5 mt -59.02 -35.87 74.0 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.288 0.367 . . . . 0.0 110.873 -178.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.9 mm-40 -57.97 -51.72 68.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.428 0.632 . . . . 0.0 110.497 174.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -63.95 -40.1 97.95 Favored Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.226 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.666 ' O ' ' HG3' ' A' 3567 ' ' MET . 73.2 t -59.62 -48.18 88.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 176.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -53.67 -42.7 68.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.196 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.561 ' O ' ' HB ' ' A' 3568 ' ' THR . 96.4 mtt180 -60.42 -44.46 95.74 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.851 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -76.55 -15.3 59.9 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.087 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.666 ' HG3' ' O ' ' A' 3563 ' ' VAL . 88.0 mtp -83.74 -19.19 35.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.687 0.756 . . . . 0.0 109.126 173.016 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3568 ' ' THR . . . . . 0.561 ' HB ' ' O ' ' A' 3565 ' ' ARG . 56.2 m -77.06 -21.59 54.23 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.009 176.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 60.5 t -116.45 84.51 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.9 177.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.0 108.13 3.4 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.581 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 1.9 m 157.88 -42.99 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.249 1.42 . . . . 0.0 108.02 -173.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -84.8 -17.36 38.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.025 -177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.714 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.1 OUTLIER -138.17 163.9 30.54 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 120.979 0.419 . . . . 0.0 109.994 177.401 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.585 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 29.3 t -126.12 135.64 51.94 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 172.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.615 HD23 ' CG1' ' A' 3527 ' ' VAL . 13.3 tp -105.97 125.54 51.11 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.534 HD11 HD22 ' A' 3524 ' ' LEU . 82.2 mt -126.72 154.89 43.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.11 0.481 . . . . 0.0 110.837 -177.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.612 ' HG ' HD13 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.83 108.02 13.43 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.611 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.481 ' HB3' HD12 ' A' 3659 ' ' ILE . . . -94.68 122.42 37.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.299 0.571 . . . . 0.0 110.495 -177.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.556 HD22 HG23 ' A' 3653 ' ' ILE . 83.4 mt -126.75 142.01 42.08 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.688 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3580 ' ' PRO . . . . . 0.454 ' HA ' ' O ' ' A' 3521 ' ' ALA . 20.5 Cg_endo -60.46 117.3 4.05 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 122.67 2.247 . . . . 0.0 112.091 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.4 p -101.58 107.8 19.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.272 0.558 . . . . 0.0 111.003 -177.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.71 146.18 16.34 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.604 -179.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 5.2 ttp85 -64.72 -35.29 80.57 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.596 0.712 . . . . 0.0 110.064 176.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.574 ' O ' HG21 ' A' 3588 ' ' VAL . 15.1 t70 -134.92 164.37 27.75 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -55.42 -38.38 68.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 117.994 0.361 . . . . 0.0 110.392 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -62.2 -44.64 96.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.507 176.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 24.4 t0 -63.71 -40.87 97.84 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.013 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.574 HG21 ' O ' ' A' 3584 ' ' ASP . 91.4 t -57.04 -48.55 81.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.043 176.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 65.5 t -57.36 -48.73 82.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.348 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 48.0 t -54.86 -53.34 56.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.097 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -66.25 -36.11 82.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.387 -177.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 78.7 m -60.73 -50.94 71.47 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 176.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3593 ' ' GLU . . . . . 0.544 ' HA ' ' HD3' ' A' 3596 ' ' LYS . 39.5 tp10 -61.3 -44.45 97.19 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.005 -178.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 37.5 m -61.36 -45.34 94.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.69 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.579 HD13 HD11 ' A' 3657 ' ' LEU . 59.5 tp -60.85 -42.77 98.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.429 178.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.556 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 50.2 mtpt -55.78 -54.16 47.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.853 177.316 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.79 -40.67 88.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.274 -176.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.405 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -89.93 -46.86 8.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -169.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.495 ' HB2' HD12 ' A' 3595 ' ' LEU . 22.3 m-85 -99.56 -50.43 4.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.753 0.311 . . . . 0.0 111.515 -175.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.556 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.0 mm -61.32 -54.39 35.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.717 -176.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 45.8 m -59.89 -41.12 90.89 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.267 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.731 ' CE2' HD21 ' A' 3603 ' ' LEU . 0.1 OUTLIER -65.98 -57.03 8.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.906 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.731 HD21 ' CE2' ' A' 3602 ' ' TYR . 0.3 OUTLIER -56.8 -43.61 81.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -177.578 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -69.63 -35.83 75.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.491 -176.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -67.86 -38.89 83.68 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.105 0.478 . . . . 0.0 110.659 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -78.81 -18.04 54.73 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.627 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 49.67 53.7 12.28 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -169.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.428 ' O ' HD11 ' A' 3603 ' ' LEU . . . -133.94 -175.89 3.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.044 -170.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.68 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.38 118.32 30.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.411 175.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3610 ' ' GLY . . . . . 0.495 ' N ' HD12 ' A' 3603 ' ' LEU . . . -63.77 104.03 0.79 Allowed Glycine 0 C--O 1.221 -0.707 0 C-N-CA 120.718 -0.753 . . . . 0.0 111.292 177.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.618 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 38.9 mm -90.12 122.45 41.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 121.333 0.587 . . . . 0.0 111.439 -173.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.605 HD12 ' HB3' ' A' 3547 ' ' LEU . 51.1 mt -119.71 111.56 33.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.221 176.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.515 ' HA ' ' O ' ' A' 3624 ' ' TYR . 0.8 OUTLIER -87.46 125.59 34.39 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' 3537 ' ' SER . 5.3 p . . . . . 0 C--N 1.315 -0.919 0 CA-C-O 121.02 0.438 . . . . 0.0 111.262 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.515 ' O ' ' HA ' ' A' 3613 ' ' ASN . 86.4 m-85 . . . . . 0 CA--C 1.506 -0.74 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.451 HG13 ' HG3' ' A' 3627 ' ' GLN . 4.1 t -122.23 113.16 37.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.902 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.64 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -94.46 111.34 23.09 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 170.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.475 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 63.0 mt-30 -94.4 110.66 22.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.76 -177.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.585 HG12 HG12 ' A' 3659 ' ' ILE . 32.8 mt -90.87 97.84 7.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.086 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -86.29 141.2 34.63 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.984 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.648 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 60.7 Cg_endo -72.92 169.69 21.52 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.486 2.124 . . . . 0.0 111.361 176.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.03 77.63 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.441 2.094 . . . . 0.0 111.64 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.522 ' O ' ' HG2' ' A' 3636 ' ' GLU . 10.4 p -112.88 162.64 15.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.044 -174.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -45.99 -39.75 9.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.469 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 46.6 t80 -61.52 -52.98 62.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.495 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 56.4 p -66.37 -54.77 20.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.927 -175.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3636 ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' 3632 ' ' CYS . 5.3 mm-40 -59.39 -38.56 80.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.268 -173.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 39.0 t -66.33 -50.11 64.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.752 0.311 . . . . 0.0 110.667 -178.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -65.81 -31.81 72.99 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.42 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.92 -30.98 72.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.956 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.736 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 20.1 m -74.84 -31.46 61.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.323 0.582 . . . . 0.0 109.89 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -79.61 -47.2 15.86 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.932 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.601 HD12 HD21 ' A' 3575 ' ' LEU . 14.7 mt -79.36 -41.8 27.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.139 -173.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -138.2 72.08 46.28 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -174.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -64.71 -19.29 64.47 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.207 1.938 . . . . 0.0 112.014 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3645 ' ' ASP . . . . . 0.483 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 6.6 m-20 -67.84 -60.78 2.25 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.559 -178.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.612 HD13 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -77.15 -26.42 53.03 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.635 -178.27 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.736 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.18 -44.12 71.27 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.231 177.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.99 -18.07 63.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.47 -178.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 17.9 m -89.62 -36.76 15.1 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.052 0.453 . . . . 0.0 110.545 177.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.639 ' HA ' HG21 ' A' 3653 ' ' ILE . 5.2 pt -83.11 -10.5 11.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.785 -174.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.4 p -60.06 -25.18 65.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.958 0.408 . . . . 0.0 110.402 176.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -83.93 -41.87 16.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.313 0.577 . . . . 0.0 110.011 173.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.639 HG21 ' HA ' ' A' 3650 ' ' ILE . 0.3 OUTLIER -99.57 34.21 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-O 123.184 1.469 . . . . 0.0 109.094 -172.366 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.447 ' N ' ' HD2' ' A' 3655 ' ' PRO . 23.2 m -34.67 -43.99 0.59 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 113.529 -1.669 . . . . 0.0 114.489 173.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' 3654 ' ' SER . 15.8 Cg_endo -60.19 86.05 0.07 OUTLIER 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.656 1.571 . . . . 0.0 111.821 170.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 3.8 p-80 -152.12 178.29 9.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.488 -176.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.579 HD11 HD13 ' A' 3595 ' ' LEU . 42.2 mt -126.9 133.62 50.63 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.474 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 60.1 ttp -97.32 109.99 22.63 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.586 HD12 HD23 ' A' 3524 ' ' LEU . 92.3 mt -100.59 116.74 44.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.28 0.562 . . . . 0.0 111.459 -173.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.714 HG12 ' HD2' ' A' 3573 ' ' TYR . 93.2 t -102.84 113.0 38.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.97 -178.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.64 HG12 ' HG ' ' A' 3626 ' ' LEU . 53.6 mt -90.78 113.13 26.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.294 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.62 127.98 55.91 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.687 0.279 . . . . 0.0 111.07 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 11.7 p -95.85 110.94 23.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.056 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 C--O 1.248 0.98 0 CA-C-O 119.409 -0.329 . . . . 0.0 111.074 -178.808 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.558 ' CD1' ' HB2' ' A' 3553 ' ' MET . 20.3 m-85 . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.596 ' CG ' ' H ' ' B' 2520 ' ' THR . 8.6 tt0 55.98 -158.24 0.23 Allowed 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 175.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B 2520 ' ' THR . . . . . 0.596 ' H ' ' CG ' ' B' 2519 ' ' GLU . 88.9 m -151.78 123.65 8.03 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 174.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.548 ' HG ' ' OH ' ' A' 3602 ' ' TYR . 0.1 OUTLIER . . . . . 0 CA--C 1.517 -0.315 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -178.328 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.59 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.7 pp . . . . . 0 N--CA 1.455 -0.194 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.637 HD11 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -71.31 -15.76 62.42 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.192 -173.31 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.637 ' N ' HD11 ' A' 3502 ' ' LEU . 23.5 tptm -69.59 -27.06 64.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.273 177.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3504 ' ' LYS . . . . . 0.708 ' HD3' ' CE2' ' A' 3505 ' ' TYR . 32.5 tttt -100.37 -42.02 6.8 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.475 179.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.708 ' CE2' ' HD3' ' A' 3504 ' ' LYS . 0.1 OUTLIER -146.71 106.9 4.02 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.308 177.038 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -86.52 174.01 6.09 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 124.27 3.313 . . . . 0.0 113.886 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.559 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 95.2 mt -72.05 138.79 20.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.118 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3508 ' ' VAL . . . . . 0.405 HG11 ' HB2' ' A' 3526 ' ' PHE . 31.7 m -105.94 -28.17 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.785 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.573 ' HE3' HD13 ' A' 3524 ' ' LEU . 21.1 t90 -153.54 154.75 34.89 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -176.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -151.14 121.4 7.27 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.117 0.484 . . . . 0.0 110.126 178.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -171.75 -123.94 0.73 Allowed Glycine 0 N--CA 1.441 -0.997 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.1 mp -141.34 158.76 43.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.1 0.476 . . . . 0.0 111.094 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.438 HD21 ' HB2' ' A' 3547 ' ' LEU . 89.5 mt -112.79 151.46 30.32 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 168.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.656 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.75 125.93 14.66 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.729 0.3 . . . . 0.0 111.575 -178.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.772 HD11 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.02 142.59 38.25 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 173.119 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.772 ' CD ' HD11 ' A' 3515 ' ' LEU . 0.5 OUTLIER 59.88 -94.93 0.05 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.119 0.485 . . . . 0.0 110.157 -171.268 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -136.47 4.78 2.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.192 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.419 ' O ' ' HA ' ' A' 3514 ' ' ALA . 47.8 m-20 -102.53 138.54 39.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.333 -172.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.479 HG23 ' HB2' ' A' 3514 ' ' ALA . 27.8 p -127.02 138.04 53.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.943 -179.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -133.83 119.97 19.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.08 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.636 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -71.92 120.19 17.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.049 0.452 . . . . 0.0 110.52 178.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.431 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 33.7 m -132.06 147.76 32.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.857 -175.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -110.95 129.9 55.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.838 172.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.573 HD13 ' HE3' ' A' 3509 ' ' TRP . 0.9 OUTLIER -98.09 110.67 23.21 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.356 0.598 . . . . 0.0 111.886 -175.51 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.559 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 54.8 m-70 -84.99 137.11 33.28 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.56 175.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.7 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.7 t80 -67.08 136.38 55.1 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 173.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.624 ' CG1' HD23 ' A' 3575 ' ' LEU . 18.8 t -115.11 -55.89 4.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.42 0.629 . . . . 0.0 110.798 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 48.0 t -159.04 171.72 19.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.708 -172.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.42 -150.22 21.14 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.766 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.541 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.7 t-20 -104.87 110.33 22.65 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -61.64 -29.6 70.17 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.544 -176.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3532 ' ' VAL . . . . . 0.532 ' HB ' ' OD1' ' A' 3530 ' ' ASN . 60.9 t -60.55 -33.46 54.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.364 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.526 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 20.4 mt -57.37 -41.46 80.21 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.944 176.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.488 ' HA ' HD11 ' A' 3661 ' ' ILE . . . -66.76 -45.62 77.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.847 0.356 . . . . 0.0 110.462 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -60.99 -33.88 73.93 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.187 -178.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -90.01 -13.91 35.04 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -178.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.45 ' HB2' HD12 ' A' 3626 ' ' LEU . 66.5 p -101.87 -34.72 9.28 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 122.014 -0.429 . . . . 0.0 111.317 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.548 HD11 ' HB2' ' A' 3509 ' ' TRP . 26.9 mt -80.44 114.08 44.57 Favored Pre-proline 0 C--N 1.319 -0.72 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -177.175 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo . . . . . 0 N--CA 1.455 -0.736 0 C-N-CA 123.073 2.515 . . . . 0.0 113.431 -169.975 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A 3546 ' ' PRO . . . . . 0.602 ' HA ' ' O ' ' A' 3512 ' ' LEU . 37.1 Cg_endo . . . . . 0 N--CA 1.461 -0.397 0 N-CA-C 112.801 0.27 . . . . 0.0 112.801 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.578 ' HB3' HD11 ' A' 3612 ' ' ILE . 37.9 mt -68.82 118.09 11.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.4 178.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.656 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.1 OUTLIER -94.24 133.75 37.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.199 0.523 . . . . 0.0 111.439 -178.116 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.566 ' HA ' HG12 ' A' 3612 ' ' ILE . 23.1 mt -84.49 108.05 16.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-O 122.185 0.993 . . . . 0.0 110.75 -177.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -105.01 -12.31 16.23 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.594 -1.184 . . . . 0.0 111.733 -171.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.612 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 87.5 mt-30 -150.36 177.55 9.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.54 -177.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.723 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.32 141.7 19.64 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 120.693 0.282 . . . . 0.0 111.411 179.495 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.62 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.5 tmm? -109.75 109.03 19.6 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 175.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3554 ' ' ARG . . . . . 0.439 ' O ' ' HG3' ' A' 3556 ' ' GLU . 49.1 mtt180 -58.97 110.97 1.14 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.578 ' O ' HD12 ' A' 3555 ' ' LEU . 2.3 pp -68.39 99.18 0.91 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 122.304 1.049 . . . . 0.0 110.56 -173.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.511 ' O ' ' HG ' ' A' 3560 ' ' LEU . 33.9 mt-10 -103.04 157.76 16.77 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.081 176.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.91 -50.53 70.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.622 0.249 . . . . 0.0 110.908 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 25.6 p -62.19 -39.66 93.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.988 0.423 . . . . 0.0 111.255 178.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.508 ' O ' HG21 ' A' 3563 ' ' VAL . 57.5 mm-40 -65.97 -41.13 91.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.563 -178.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.516 HD23 ' HB2' ' A' 3555 ' ' LEU . 83.7 mt -64.24 -34.78 78.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.779 0.323 . . . . 0.0 110.809 -179.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' 3557 ' ' ALA . 12.1 mm-40 -68.66 -41.66 79.0 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 174.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -57.8 -41.51 94.04 Favored Glycine 0 CA--C 1.517 0.164 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.796 175.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.553 ' O ' ' HG3' ' A' 3567 ' ' MET . 95.5 t -61.7 -51.38 73.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 174.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3564 ' ' ALA . . . . . 0.515 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.63 -24.05 63.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.903 -178.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -61.15 -40.02 92.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.88 0.371 . . . . 0.0 110.536 -179.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -87.99 -14.69 38.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.998 0.427 . . . . 0.0 110.569 176.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.553 ' HG3' ' O ' ' A' 3563 ' ' VAL . 84.9 mtp -74.68 -19.9 60.08 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.188 -178.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 14.7 t -89.01 3.29 52.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.112 0.482 . . . . 0.0 110.078 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 28.1 t -125.99 91.27 1.75 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.52 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -67.56 110.23 3.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.349 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.541 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 144.19 -38.98 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.561 1.544 . . . . 0.0 108.583 -177.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -82.19 -20.65 37.39 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.782 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.73 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.1 OUTLIER -144.38 165.55 27.59 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.195 176.876 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.572 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 37.2 t -127.8 135.99 50.85 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 170.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.624 HD23 ' CG1' ' A' 3527 ' ' VAL . 14.7 tp -106.46 125.45 51.01 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.549 HD13 HD22 ' A' 3524 ' ' LEU . 78.7 mt -126.57 153.44 45.23 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.203 0.525 . . . . 0.0 110.558 -178.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.619 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.0 108.12 13.92 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.974 -0.751 . . . . 0.0 108.974 -179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.474 ' HB1' HD13 ' A' 3659 ' ' ILE . . . -94.4 121.18 35.67 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.363 0.601 . . . . 0.0 110.449 -177.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.422 ' HG ' HD12 ' A' 3577 ' ' LEU . 68.2 mt -121.04 144.11 38.55 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 114.744 -1.117 . . . . 0.0 110.142 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.09 109.9 0.91 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.215 1.944 . . . . 0.0 111.705 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 18.2 p -95.96 115.72 27.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.208 0.528 . . . . 0.0 110.2 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3582 ' ' GLY . . . . . 0.417 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -102.38 145.87 16.66 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.432 -0.889 . . . . 0.0 112.963 -176.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -19.35 63.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.827 0.822 . . . . 0.0 109.689 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.641 ' O ' HG23 ' A' 3588 ' ' VAL . 31.7 t70 -156.97 164.41 38.05 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -57.17 -35.57 69.71 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.021 0.439 . . . . 0.0 110.351 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.53 -41.52 79.8 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.778 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.453 ' HB3' ' H ' ' A' 3584 ' ' ASP . 13.9 t70 -61.94 -40.53 95.87 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.362 177.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.641 HG23 ' O ' ' A' 3584 ' ' ASP . 58.6 t -57.18 -45.04 84.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.271 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.325 178.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 7.1 t -62.31 -53.66 44.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.472 0.653 . . . . 0.0 109.616 -178.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 53.6 m -54.55 -48.88 71.49 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.601 178.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -68.89 -34.28 75.15 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -179.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 87.0 m -61.06 -46.77 89.34 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.851 -0.339 . . . . 0.0 110.115 177.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -64.84 -45.08 87.6 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.979 179.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 70.4 m -53.52 -43.45 68.32 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.736 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.566 HD12 HD11 ' A' 3657 ' ' LEU . 53.4 tp -67.86 -44.09 77.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.719 177.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.58 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 49.6 mtpt -57.98 -57.99 10.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.894 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -63.01 -34.68 78.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.606 -177.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.458 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.84 -47.43 6.15 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -171.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.498 ' HB2' HD13 ' A' 3595 ' ' LEU . 17.2 m-85 -99.62 -50.75 3.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.736 0.303 . . . . 0.0 111.529 -174.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.58 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.4 mm -61.5 -50.88 78.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.424 -176.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 60.4 m -58.73 -50.01 75.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.518 178.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.715 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.2 OUTLIER -59.75 -58.67 7.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.561 -178.913 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.715 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.4 OUTLIER -54.59 -41.35 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -176.679 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -79.28 -37.37 37.97 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.707 -176.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.29 -39.73 81.99 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.007 0.432 . . . . 0.0 111.185 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3606 ' ' LYS . . . . . 0.429 ' HG3' ' CD1' ' A' 3602 ' ' TYR . 21.6 mmmt -81.51 -15.79 53.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.928 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 52.79 65.42 1.52 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.338 -173.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.588 ' O ' HD11 ' A' 3603 ' ' LEU . . . -146.15 -174.6 4.48 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.916 0.388 . . . . 0.0 111.801 -175.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.723 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -121.81 118.75 29.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.65 177.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3610 ' ' GLY . . . . . 0.53 ' N ' HD13 ' A' 3603 ' ' LEU . . . -63.98 103.15 0.66 Allowed Glycine 0 C--O 1.221 -0.661 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.833 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.612 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 39.7 mm -89.38 120.9 38.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 121.312 0.577 . . . . 0.0 111.092 -174.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.578 HD11 ' HB3' ' A' 3547 ' ' LEU . 32.8 mt -120.52 107.43 20.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.862 176.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' 3624 ' ' TYR . 48.9 m-80 -82.54 127.0 32.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.868 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 35.0 m . . . . . 0 C--N 1.321 -0.668 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.618 179.495 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.438 ' O ' ' HA ' ' A' 3613 ' ' ASN . 72.0 m-85 . . . . . 0 CA--C 1.513 -0.48 0 CA-C-O 120.972 0.415 . . . . 0.0 110.419 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.417 HG13 HD13 ' A' 3611 ' ' ILE . 4.5 t -120.5 116.01 48.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.234 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.611 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -97.57 111.71 23.87 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 169.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.42 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 39.1 mt-30 -94.76 111.29 23.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.067 -177.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.591 HG12 HG12 ' A' 3659 ' ' ILE . 45.2 mt -89.61 98.91 8.63 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.294 178.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -88.34 139.5 30.18 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.996 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.54 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 47.5 Cg_endo -68.56 172.95 10.59 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.73 2.287 . . . . 0.0 111.765 178.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.03 37.45 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.778 2.318 . . . . 0.0 112.359 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.465 ' H ' ' C ' ' A' 3630 ' ' PRO . 24.4 p -77.71 163.47 26.14 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.908 -178.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -44.67 -40.94 6.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.288 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3634 ' ' PHE . . . . . 0.45 ' HB2' HD11 ' A' 3560 ' ' LEU . 51.2 t80 -52.67 -51.53 59.83 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 34.4 p -70.08 -54.22 14.03 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.126 -173.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -58.81 -37.66 76.87 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -176.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 15.0 t -62.82 -50.71 69.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.094 0.473 . . . . 0.0 110.341 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -67.71 -32.72 73.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.647 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3639 ' ' LEU . . . . . 0.408 ' HB3' HD23 ' A' 3647 ' ' LEU . 79.1 mt -63.94 -39.51 94.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.726 176.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3640 ' ' SER . . . . . . . . . . . . . 46.6 m -67.21 -26.76 66.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.265 0.555 . . . . 0.0 110.298 178.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 24.9 ttm180 -80.42 -47.52 14.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.759 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.589 HD12 HD22 ' A' 3575 ' ' LEU . 9.9 mt -86.9 -31.82 20.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.908 -170.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.47 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -150.45 73.24 9.07 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -174.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.24 -16.4 48.37 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.723 2.282 . . . . 0.0 111.958 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3645 ' ' ASP . . . . . 0.605 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 3.9 m-20 -71.92 -55.03 8.22 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.083 -178.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.619 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.5 -30.19 47.03 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.889 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.496 ' HA ' ' CG1' ' A' 3650 ' ' ILE . 3.3 tm? -54.5 -43.2 71.61 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.909 0.385 . . . . 0.0 110.235 177.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.25 -21.69 66.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.511 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 14.7 t -90.1 -31.12 17.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.89 0.376 . . . . 0.0 110.728 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.519 ' HA ' HG23 ' A' 3653 ' ' ILE . 5.0 pt -84.72 -11.4 11.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.768 -175.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 10.7 p -62.78 -20.5 65.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.025 0.441 . . . . 0.0 110.521 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -85.51 -38.05 18.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.254 0.549 . . . . 0.0 109.94 173.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.519 HG23 ' HA ' ' A' 3650 ' ' ILE . 9.1 tp -105.22 41.17 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 122.322 1.058 . . . . 0.0 109.446 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.466 ' N ' ' HD2' ' A' 3655 ' ' PRO . 64.5 m -36.71 -44.51 1.17 Allowed Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 114.26 -1.336 . . . . 0.0 113.837 172.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' 3654 ' ' SER . 12.8 Cg_endo -58.73 88.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.491 1.46 . . . . 0.0 111.744 169.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -157.16 177.67 11.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.343 -177.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.566 HD11 HD12 ' A' 3595 ' ' LEU . 36.3 mt -127.96 139.67 52.44 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.81 -178.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 55.6 ttp -102.48 109.27 20.85 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.591 HG12 HG12 ' A' 3628 ' ' ILE . 79.4 mt -101.21 116.29 44.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-O 121.291 0.567 . . . . 0.0 111.25 -173.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.73 HG12 ' HD2' ' A' 3573 ' ' TYR . 71.7 t -101.6 115.71 43.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.928 -177.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.611 HG12 ' HG ' ' A' 3626 ' ' LEU . 64.9 mt -90.84 112.7 25.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -114.31 127.7 55.99 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.898 0.38 . . . . 0.0 111.599 -177.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 53.0 m -84.42 135.12 34.4 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.008 171.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 5.9 p . . . . . 0 C--O 1.249 1.071 0 CA-C-O 119.008 -0.52 . . . . 0.0 109.67 176.155 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.62 ' CD1' ' HB2' ' A' 3553 ' ' MET . 38.3 m-85 . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 111.501 0.186 . . . . 0.0 111.501 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.567 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 4.9 mm-40 52.38 -152.14 0.26 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.551 0.691 . . . . 0.0 110.788 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 76.3 m -153.27 117.19 4.78 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 169.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.639 HD22 ' NH1' ' A' 3552 ' ' ARG . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.264 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.542 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.1 pp . . . . . 0 CA--C 1.53 0.19 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.629 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -69.09 -15.99 63.57 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 118.502 0.592 . . . . 0.0 110.872 -172.26 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.629 ' N ' HD13 ' A' 3502 ' ' LEU . 7.7 mmpt? -78.51 -15.61 58.4 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.969 0.414 . . . . 0.0 109.921 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -101.02 -43.69 5.96 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 174.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.699 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.7 103.65 3.05 Favored Pre-proline 0 N--CA 1.443 -0.789 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.715 179.786 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -84.0 174.97 7.96 Favored 'Trans proline' 0 CA--C 1.531 0.373 0 C-N-CA 124.381 3.387 . . . . 0.0 113.705 -176.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.425 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 93.0 mt -70.63 139.41 20.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.044 179.241 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 27.4 m -107.17 -26.27 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.357 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.759 ' HE3' HD12 ' A' 3524 ' ' LEU . 61.2 t90 -153.87 145.41 23.21 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -142.42 120.02 11.78 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.98 -128.19 1.01 Allowed Glycine 0 N--CA 1.442 -0.942 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -178.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.595 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.0 mp -139.45 151.84 46.55 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.051 0.453 . . . . 0.0 110.901 179.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.45 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 78.6 mt -105.74 146.03 30.35 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 168.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.648 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -141.47 123.39 15.37 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.755 -176.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.722 HD13 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.15 146.49 40.69 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 173.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.722 ' CD ' HD13 ' A' 3515 ' ' LEU . 1.1 mptm? 59.17 -92.91 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.179 0.592 . . . . 0.0 110.549 -171.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 10.0 m120 -142.08 4.98 1.68 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.187 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -103.02 135.73 44.17 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.384 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.459 HG22 ' HB3' ' A' 3514 ' ' ALA . 7.2 p -116.31 132.25 56.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.867 177.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -124.27 112.86 17.51 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.71 176.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.595 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.78 121.32 17.8 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.433 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -132.64 147.79 31.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.733 0.777 . . . . 0.0 111.911 -175.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -108.31 124.92 51.07 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.787 173.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.759 HD12 ' HE3' ' A' 3509 ' ' TRP . 1.4 mt -94.38 108.77 20.67 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.718 -175.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.425 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 83.7 m-70 -85.66 136.93 33.17 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.826 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.699 ' O ' ' HB2' ' A' 3505 ' ' TYR . 68.0 t80 -67.23 137.77 56.43 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.633 ' CG1' HD21 ' A' 3575 ' ' LEU . 23.5 t -114.94 -56.43 4.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.53 0.681 . . . . 0.0 110.565 175.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 57.7 m -163.57 173.06 13.49 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.549 -171.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3529 ' ' GLY . . . . . 0.444 ' HA3' ' HA ' ' A' 3574 ' ' CYS . . . 90.78 -165.0 30.5 Favored Glycine 0 C--O 1.229 -0.2 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.253 177.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.567 ' HB2' ' HA ' ' A' 3571 ' ' THR . 49.2 t30 -92.72 108.48 20.02 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.618 0.247 . . . . 0.0 110.539 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 7.8 p30 -61.12 -25.02 66.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.405 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 59.2 t -62.5 -32.87 56.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.947 0.403 . . . . 0.0 110.422 178.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.429 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 24.9 mt -60.52 -39.39 87.62 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.603 177.142 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.459 ' HA ' HD12 ' A' 3661 ' ' ILE . . . -67.69 -40.95 84.32 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-O 120.72 0.295 . . . . 0.0 110.611 -178.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -59.59 -41.63 90.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.856 178.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -89.32 -7.74 54.73 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -174.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.534 ' HB2' HD13 ' A' 3626 ' ' LEU . 66.7 p -104.36 -41.6 5.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.086 0.47 . . . . 0.0 110.876 178.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.576 HD11 ' HB2' ' A' 3509 ' ' TRP . 25.7 mt -80.31 113.64 40.65 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.627 -178.045 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo . . . . . 0 N--CA 1.452 -0.931 0 C-N-CA 122.39 2.06 . . . . 0.0 112.415 -176.271 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 N--CA 1.459 -0.541 0 N-CA-C 111.613 -0.187 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.574 ' HB3' HD12 ' A' 3612 ' ' ILE . 36.0 mt -68.95 112.11 5.4 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.648 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -95.5 138.61 32.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.033 0.444 . . . . 0.0 110.792 -177.101 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.483 ' HA ' HG12 ' A' 3612 ' ' ILE . 17.9 mt -90.54 107.7 18.77 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 CA-C-O 122.155 0.979 . . . . 0.0 111.145 -174.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -106.99 -5.78 17.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.722 -1.126 . . . . 0.0 111.913 -172.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.638 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 85.0 mt-30 -150.92 175.65 11.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.654 0.264 . . . . 0.0 111.004 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.75 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -149.92 138.9 21.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.049 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.587 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 22.0 ttt -109.77 107.73 17.83 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.276 175.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 34.6 mtm180 -60.09 110.73 1.28 Allowed 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.804 0.335 . . . . 0.0 110.127 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.515 ' HB2' HD21 ' A' 3560 ' ' LEU . 1.8 pp -76.58 97.33 4.36 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.164 0.983 . . . . 0.0 109.863 -176.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.58 ' O ' ' HG ' ' A' 3560 ' ' LEU . 31.4 mt-10 -106.54 168.86 8.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.595 178.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.465 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.73 -50.57 68.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.724 0.297 . . . . 0.0 110.62 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 8.2 p -60.94 -40.89 94.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.389 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.563 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 77.8 mm-40 -66.31 -42.69 87.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.103 -177.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' 3556 ' ' GLU . 84.3 mt -60.39 -35.31 75.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.751 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' 3557 ' ' ALA . 15.0 mm-40 -59.89 -46.33 89.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.093 174.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -63.0 -38.76 97.14 Favored Glycine 0 N--CA 1.452 -0.247 0 CA-C-N 115.437 -0.802 . . . . 0.0 112.337 177.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.583 ' O ' ' HG3' ' A' 3567 ' ' MET . 62.1 t -62.02 -54.26 36.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.623 0.249 . . . . 0.0 110.429 177.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -60.87 -29.79 69.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.865 0.364 . . . . 0.0 111.11 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.419 ' O ' HG22 ' A' 3568 ' ' THR . 3.0 tmt_? -59.93 -42.5 94.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.58 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -87.65 -10.34 51.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.197 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.583 ' HG3' ' O ' ' A' 3563 ' ' VAL . 85.9 mtp -85.24 -18.91 32.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.813 0.339 . . . . 0.0 111.413 -179.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3568 ' ' THR . . . . . 0.419 HG22 ' O ' ' A' 3565 ' ' ARG . 12.0 t -82.96 -7.35 59.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.03 0.443 . . . . 0.0 110.529 -178.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 55.2 t -117.65 93.83 2.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-O 121.043 0.449 . . . . 0.0 110.202 178.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -74.67 108.11 7.21 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.567 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.8 m 154.59 -41.66 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.482 1.513 . . . . 0.0 107.669 -172.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -87.01 -26.11 23.92 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.179 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.841 ' HD2' HG11 ' A' 3660 ' ' VAL . 0.1 OUTLIER -132.62 163.56 28.63 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.931 177.472 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.571 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 42.1 t -128.29 136.63 51.26 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 170.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.633 HD21 ' CG1' ' A' 3527 ' ' VAL . 13.3 tp -105.2 126.11 51.73 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.551 HD13 HD23 ' A' 3524 ' ' LEU . 79.4 mt -127.87 153.85 46.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.904 -177.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.753 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -119.56 108.23 14.25 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.415 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.469 ' HB2' HD13 ' A' 3659 ' ' ILE . . . -94.18 120.71 34.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.39 0.614 . . . . 0.0 110.337 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.564 ' HG ' HD11 ' A' 3577 ' ' LEU . 62.5 mt -123.09 145.32 45.69 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.855 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.62 126.73 22.16 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.377 2.051 . . . . 0.0 112.213 179.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 31.5 p -119.14 116.46 26.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.111 0.481 . . . . 0.0 109.871 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.32 146.05 16.39 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.464 -0.874 . . . . 0.0 112.23 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 36.3 mtm180 -59.64 -46.79 87.94 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.444 0.64 . . . . 0.0 109.771 175.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.54 ' O ' HG23 ' A' 3588 ' ' VAL . 4.8 m-20 -132.12 177.06 7.85 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.564 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -55.58 -43.0 75.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.931 0.396 . . . . 0.0 110.558 179.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.09 -46.5 90.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.246 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' A' 3591 ' ' GLN . 15.0 t70 -63.47 -40.88 98.3 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.001 -178.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' 3584 ' ' ASP . 72.1 t -53.85 -47.18 63.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.774 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 94.2 t -60.62 -46.5 95.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.304 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 46.8 t -62.61 -44.94 95.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.404 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3591 ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' 3587 ' ' ASP . 72.1 mm-40 -64.35 -42.0 96.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.762 0.315 . . . . 0.0 110.287 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3592 ' ' THR . . . . . 0.433 ' O ' ' HG3' ' A' 3596 ' ' LYS . 57.8 m -59.63 -53.45 57.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.861 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3593 ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' A' 3596 ' ' LYS . 11.2 pt-20 -65.5 -35.07 79.8 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 121.044 -0.263 . . . . 0.0 111.638 -177.091 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 38.1 m -65.43 -44.17 88.18 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.558 HD13 HD11 ' A' 3657 ' ' LEU . 53.3 tp -63.01 -44.76 95.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.476 178.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.561 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 58.9 mtpt -56.4 -58.18 9.1 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.67 177.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.44 -33.46 75.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.702 -175.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.585 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.62 -46.44 6.63 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -171.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.507 ' HB2' HD11 ' A' 3595 ' ' LEU . 19.8 m-85 -99.71 -50.46 4.04 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.79 0.329 . . . . 0.0 111.339 -173.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.561 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 23.4 mm -62.61 -52.6 57.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.032 -176.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 75.3 m -59.49 -45.25 92.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.037 178.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.754 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.0 OUTLIER -66.6 -56.34 11.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.568 -178.14 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.754 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -55.18 -44.3 75.12 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -175.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -73.85 -34.23 64.42 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.685 -176.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.76 -38.4 80.07 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.207 0.527 . . . . 0.0 110.646 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -77.69 -18.64 56.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.445 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 50.72 53.74 12.45 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.484 -169.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.522 ' O ' HD13 ' A' 3603 ' ' LEU . . . -136.26 -175.53 4.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.734 -172.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.75 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.47 121.33 38.24 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.678 177.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3610 ' ' GLY . . . . . 0.535 ' N ' HD12 ' A' 3603 ' ' LEU . . . -63.92 101.53 0.49 Allowed Glycine 0 C--O 1.222 -0.654 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.142 177.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.638 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 29.3 mm -89.97 125.58 42.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.192 0.52 . . . . 0.0 110.928 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.574 HD12 ' HB3' ' A' 3547 ' ' LEU . 41.1 mt -124.63 117.32 50.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.714 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 11.4 m120 -83.34 141.81 31.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.285 -175.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.522 ' O ' ' HB2' ' A' 3624 ' ' TYR . 58.8 t . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.458 178.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.522 ' HB2' ' O ' ' A' 3614 ' ' VAL . 68.0 m-85 . . . . . 0 CA--C 1.502 -0.885 0 CA-C-O 121.441 0.639 . . . . 0.0 109.6 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.542 HG13 ' HG3' ' A' 3627 ' ' GLN . 6.1 t -131.67 113.18 22.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.016 -176.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.639 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -92.31 111.52 23.12 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 171.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.542 ' HG3' HG13 ' A' 3625 ' ' VAL . 50.2 mt-30 -94.33 110.28 22.05 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.757 -177.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.591 HG12 HG12 ' A' 3659 ' ' ILE . 46.8 mt -93.72 97.66 7.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.184 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -87.92 143.64 33.6 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.905 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.453 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 42.9 Cg_endo -67.58 171.07 12.49 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.554 2.169 . . . . 0.0 111.396 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.52 41.66 0.53 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 122.844 2.363 . . . . 0.0 112.816 178.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 15.4 p -75.7 161.7 28.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.919 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3633 ' ' GLU . . . . . 0.42 ' OE2' ' HB2' ' A' 3637 ' ' SER . 4.4 tm-20 -48.85 -44.23 39.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.763 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 21.3 t80 -49.38 -49.85 42.85 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.477 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3635 ' ' SER . . . . . 0.455 ' HA ' ' HE2' ' A' 3658 ' ' MET . 9.5 m -63.56 -54.96 27.89 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.962 -177.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3636 ' ' GLU . . . . . 0.412 ' HA ' HD12 ' A' 3639 ' ' LEU . 3.7 mm-40 -62.5 -34.25 76.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.993 -175.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3637 ' ' SER . . . . . 0.42 ' HB2' ' OE2' ' A' 3633 ' ' GLU . 34.2 t -61.22 -50.52 72.76 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.701 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -65.28 -35.46 81.08 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.066 178.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3639 ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' 3636 ' ' GLU . 88.5 mt -63.89 -39.2 93.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.977 177.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3640 ' ' SER . . . . . 1.027 ' HA ' HD21 ' A' 3647 ' ' LEU . 33.6 t -59.72 -37.52 79.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.173 0.511 . . . . 0.0 110.718 177.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 31.6 mtp180 -83.88 -37.66 22.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.28 -179.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.598 HD11 HD23 ' A' 3575 ' ' LEU . 23.5 mt -87.69 -31.13 19.88 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -172.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.489 ' HB3' ' CZ ' ' A' 3505 ' ' TYR . . . -154.66 87.34 3.43 Favored Pre-proline 0 N--CA 1.465 0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 111.659 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -74.76 -21.75 16.12 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 122.577 2.185 . . . . 0.0 113.783 -175.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.25 -53.09 10.48 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.394 -0.523 . . . . 0.0 109.842 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.753 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -71.06 -26.44 63.08 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 1.027 HD21 ' HA ' ' A' 3640 ' ' SER . 25.2 tp -53.27 -49.69 66.4 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.353 175.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -58.1 -27.2 63.48 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.016 0.436 . . . . 0.0 110.846 -178.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 13.6 m -77.85 -45.15 25.14 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.243 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.576 ' HA ' ' CG2' ' A' 3653 ' ' ILE . 3.8 pt -73.87 -20.13 17.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.82 0.343 . . . . 0.0 111.566 -175.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.5 m -58.09 -28.21 64.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.968 0.413 . . . . 0.0 110.309 175.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -88.51 -34.5 17.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.737 175.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.576 ' CG2' ' HA ' ' A' 3650 ' ' ILE . 9.3 tp -104.99 42.68 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 122.662 1.22 . . . . 0.0 109.014 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.491 ' N ' ' HD2' ' A' 3655 ' ' PRO . 5.4 p -40.1 -38.0 0.95 Allowed Pre-proline 0 CA--C 1.54 0.587 0 CA-C-N 113.61 -1.632 . . . . 0.0 114.216 172.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' 3654 ' ' SER . 19.4 Cg_endo -62.95 78.57 0.11 Allowed 'Trans proline' 0 C--N 1.359 1.113 0 CA-C-N 120.832 1.333 . . . . 0.0 111.415 169.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3656 ' ' HIS . . . . . 0.44 ' HB2' HD22 ' A' 3579 ' ' LEU . 20.5 p80 -148.19 176.17 10.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.061 -177.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.558 HD11 HD13 ' A' 3595 ' ' LEU . 28.0 mt -122.49 152.34 40.41 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.204 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3658 ' ' MET . . . . . 0.455 ' HE2' ' HA ' ' A' 3635 ' ' SER . 13.4 tmm? -115.34 113.24 23.54 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 175.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.591 HG12 HG12 ' A' 3628 ' ' ILE . 80.9 mt -107.55 123.2 62.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.35 0.595 . . . . 0.0 111.971 -170.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.841 HG11 ' HD2' ' A' 3573 ' ' TYR . 78.9 t -108.25 112.7 41.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.644 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.639 HG12 ' HG ' ' A' 3626 ' ' LEU . 58.1 mt -90.57 112.33 24.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -128.35 143.46 51.01 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.437 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 14.6 m -94.42 107.97 19.91 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 42.8 t . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.455 -0.783 . . . . 0.0 110.193 -178.311 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.527 ' CD1' ' HB2' ' A' 3553 ' ' MET . 64.7 m-85 . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 119.677 -0.201 . . . . 0.0 111.403 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.598 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.8 OUTLIER 56.93 -160.9 0.22 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.526 0.679 . . . . 0.0 111.391 179.233 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 19.2 m -146.53 115.9 7.07 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 166.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.497 HD11 ' HD2' ' A' 3552 ' ' ARG . 20.3 tp . . . . . 0 N--CA 1.454 -0.254 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.817 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.558 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp . . . . . 0 C--O 1.226 -0.144 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.595 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.27 -15.55 62.92 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.818 -175.91 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.595 ' N ' HD12 ' A' 3502 ' ' LEU . 18.9 ttpp -65.21 -25.14 67.57 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.563 176.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -105.57 -42.14 5.28 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.745 175.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.664 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.27 108.75 3.19 Favored Pre-proline 0 CA--C 1.536 0.411 0 CA-C-O 121.38 0.609 . . . . 0.0 111.445 -178.624 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 3506 ' ' PRO . . . . . 0.402 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 83.0 Cg_endo -85.49 174.54 6.79 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 124.221 3.281 . . . . 0.0 113.798 -179.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.512 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.6 mt -72.14 134.46 29.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.03 -179.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3508 ' ' VAL . . . . . 0.413 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.5 m -101.25 -31.92 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.504 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.62 ' CB ' HD11 ' A' 3538 ' ' LEU . 34.8 t-105 -149.08 152.53 36.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.745 0.307 . . . . 0.0 110.566 -177.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -145.51 118.18 8.62 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 175.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.75 -134.51 1.72 Allowed Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -139.76 151.35 45.73 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.296 0.569 . . . . 0.0 111.532 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.451 HD21 ' HB2' ' A' 3547 ' ' LEU . 73.9 mt -105.45 151.97 23.58 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 170.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.673 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.91 125.15 12.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.644 0.259 . . . . 0.0 111.572 -178.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.797 HD13 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.97 142.9 40.48 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 173.966 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.797 ' CD ' HD13 ' A' 3515 ' ' LEU . 0.5 OUTLIER 57.47 -93.39 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.496 0.497 . . . . 0.0 109.755 -169.838 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -140.65 7.33 2.1 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.419 ' HB3' ' HB2' ' A' 3598 ' ' ALA . 7.3 m-20 -95.09 144.14 25.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.059 -174.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 17.8 p -132.28 144.12 50.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.963 0.411 . . . . 0.0 111.472 -177.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -139.63 113.82 8.94 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.774 175.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.576 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.29 112.82 9.7 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.41 ' HA ' ' O ' ' A' 3579 ' ' LEU . 26.9 m -125.06 147.78 29.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.623 0.725 . . . . 0.0 112.237 -173.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3523 ' ' GLN . . . . . 0.478 HE21 ' HB3' ' A' 3581 ' ' CYS . 10.6 pt20 -106.03 132.72 51.78 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.604 -1.18 . . . . 0.0 108.577 172.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.543 HD22 HD13 ' A' 3576 ' ' LEU . 1.1 mt -104.66 109.11 20.91 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.437 0.637 . . . . 0.0 111.738 -175.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.512 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 76.3 m-70 -84.42 138.44 32.83 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.106 -0.952 . . . . 0.0 108.638 175.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.664 ' O ' ' HB2' ' A' 3505 ' ' TYR . 61.5 t80 -68.05 137.46 55.05 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 174.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.601 ' CG1' HD21 ' A' 3575 ' ' LEU . 19.8 t -114.8 -56.76 4.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.281 0.562 . . . . 0.0 111.1 177.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 22.7 t -160.57 171.5 18.84 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.422 -173.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.45 -148.02 20.36 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.719 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.58 ' HB2' ' HA ' ' A' 3571 ' ' THR . 38.1 t30 -108.63 116.77 32.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.744 0.307 . . . . 0.0 110.975 -178.341 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -68.67 -23.53 64.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.167 -176.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3532 ' ' VAL . . . . . 0.449 ' O ' ' HG2' ' A' 3536 ' ' ARG . 90.0 t -59.71 -36.29 64.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.876 0.37 . . . . 0.0 110.313 177.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.484 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 59.1 mt -59.33 -37.42 77.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.874 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.423 ' HB3' ' CD1' ' A' 3538 ' ' LEU . . . -69.47 -41.4 76.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.619 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 15.6 t60 -60.39 -36.26 77.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.151 -177.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3536 ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' 3532 ' ' VAL . 12.5 ptp180 -89.13 -26.66 21.21 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.2 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.607 ' O ' HG11 ' A' 3614 ' ' VAL . 72.8 p -86.72 -38.94 16.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.119 0.485 . . . . 0.0 110.904 -178.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.62 HD11 ' CB ' ' A' 3509 ' ' TRP . 22.0 mt -81.51 123.57 80.83 Favored Pre-proline 0 C--N 1.316 -0.855 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo . . . . . 0 N--CA 1.448 -1.154 0 C-N-CA 121.801 1.667 . . . . 0.0 111.383 -178.383 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 N--CA 1.462 -0.328 0 CA-C-O 121.1 0.375 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.576 ' HB3' HD11 ' A' 3612 ' ' ILE . 49.9 mt -81.82 112.74 19.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.261 177.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' A' 3514 ' ' ALA . 21.7 ptt85 -90.34 141.51 28.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.871 0.367 . . . . 0.0 111.196 -177.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.532 ' CG2' HD11 ' B' 2521 ' ' LEU . 20.2 mt -95.02 107.14 19.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.865 0.841 . . . . 0.0 110.636 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.425 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -110.83 -4.15 15.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.594 -172.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.649 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 52.9 mt-30 -150.97 176.49 11.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.955 -0.111 . . . . 0.0 111.022 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.762 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -160.38 140.13 11.13 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -177.78 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.571 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -112.4 125.21 53.96 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.72 -0.218 . . . . 0.0 110.641 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3554 ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' 3554 ' ' ARG . 13.6 mmt85 -68.82 110.3 4.29 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.589 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -72.35 98.57 2.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 122.293 1.045 . . . . 0.0 110.318 -175.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.567 ' O ' ' HG ' ' A' 3560 ' ' LEU . 37.8 mt-10 -106.24 156.88 18.02 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.492 177.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -53.96 -50.24 66.95 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.125 0.266 . . . . 0.0 111.295 -177.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 18.7 p -63.98 -42.54 97.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.905 0.383 . . . . 0.0 111.246 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.494 ' O ' HG21 ' A' 3563 ' ' VAL . 80.9 mm-40 -61.37 -42.46 98.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.078 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' 3556 ' ' GLU . 94.0 mt -65.18 -31.9 73.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.199 -178.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' 3557 ' ' ALA . 22.4 mm-40 -66.78 -45.27 79.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.214 0.53 . . . . 0.0 109.636 175.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -57.66 -41.75 93.89 Favored Glycine 0 CA--C 1.519 0.291 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.036 174.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.575 ' O ' ' HG3' ' A' 3567 ' ' MET . 97.1 t -61.94 -46.75 95.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.843 0.354 . . . . 0.0 110.207 177.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -62.61 -25.48 68.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.541 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.454 ' O ' HG22 ' A' 3568 ' ' THR . 41.5 ttm105 -63.61 -34.58 78.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.64 178.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3566 ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' 3563 ' ' VAL . 10.5 ptp180 -86.45 -18.97 30.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.19 0.519 . . . . 0.0 109.889 176.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' 3563 ' ' VAL . 90.0 mtp -75.44 -22.29 57.47 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.917 -177.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3568 ' ' THR . . . . . 0.454 HG22 ' O ' ' A' 3565 ' ' ARG . 6.1 t -80.22 -8.65 59.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.126 0.489 . . . . 0.0 110.25 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.4 t -113.16 89.65 1.34 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.354 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.91 110.45 6.42 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.072 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.58 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 3.3 m 147.48 -39.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.894 1.677 . . . . 0.0 107.819 -177.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.02 -30.79 44.4 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.665 -179.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.79 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -133.43 167.14 20.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.068 178.464 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.595 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 35.2 t -128.11 137.06 51.97 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 172.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.601 HD21 ' CG1' ' A' 3527 ' ' VAL . 14.1 tp -106.43 125.52 51.1 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.543 HD13 HD22 ' A' 3524 ' ' LEU . 80.3 mt -128.23 155.22 44.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.177 0.513 . . . . 0.0 110.899 -177.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.733 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.4 OUTLIER -122.12 108.53 13.45 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.407 179.367 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.453 ' HB3' HD11 ' A' 3659 ' ' ILE . . . -95.0 125.91 39.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.289 0.566 . . . . 0.0 110.706 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.486 HD22 ' HB2' ' A' 3656 ' ' HIS . 75.3 mt -125.24 144.44 47.48 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.242 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -61.87 112.22 1.44 Allowed 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.347 2.031 . . . . 0.0 111.874 178.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3581 ' ' CYS . . . . . 0.478 ' HB3' HE21 ' A' 3523 ' ' GLN . 26.4 p -104.7 120.61 41.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.868 0.366 . . . . 0.0 110.345 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3582 ' ' GLY . . . . . 0.404 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.07 145.17 16.19 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.849 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -67.13 -38.55 85.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.743 0.782 . . . . 0.0 109.465 176.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.567 ' O ' HG21 ' A' 3588 ' ' VAL . 29.1 t70 -136.73 169.68 17.34 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.524 -1.216 . . . . 0.0 107.808 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -56.65 -37.1 70.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.287 0.494 . . . . 0.0 110.512 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -60.72 -46.55 89.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.285 0.564 . . . . 0.0 109.509 176.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 23.4 t70 -64.37 -42.54 96.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.785 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.567 HG21 ' O ' ' A' 3584 ' ' ASP . 89.6 t -54.76 -47.49 74.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.776 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 87.8 t -58.95 -49.44 83.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.385 178.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 23.0 t -60.07 -48.91 79.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.765 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -63.37 -37.83 88.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.859 -0.155 . . . . 0.0 111.413 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 66.5 m -61.51 -52.0 66.28 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.068 0.461 . . . . 0.0 110.484 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3593 ' ' GLU . . . . . 0.495 ' HA ' ' HG2' ' A' 3596 ' ' LYS . 26.9 mt-10 -68.55 -38.66 80.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.886 -179.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 18.3 t -58.03 -49.65 76.14 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.136 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.579 HD12 HD12 ' A' 3657 ' ' LEU . 57.8 tp -62.5 -46.69 87.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.327 -178.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.811 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 65.7 pttt -70.35 -33.85 71.95 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.143 -175.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -77.82 -37.34 48.84 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 121.041 -0.264 . . . . 0.0 111.709 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.419 ' HB2' ' HB3' ' A' 3518 ' ' ASP . . . -91.96 -46.95 7.55 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -172.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.5 ' HB2' HD11 ' A' 3595 ' ' LEU . 14.8 m-85 -98.7 -49.74 4.49 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.637 0.256 . . . . 0.0 111.294 -174.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.811 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 25.1 mm -60.55 -55.31 25.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.708 -178.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 64.2 m -57.63 -38.46 75.03 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.208 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.773 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.1 OUTLIER -68.84 -57.11 6.02 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.866 178.522 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.773 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.22 -41.91 76.4 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.569 0.223 . . . . 0.0 111.55 -177.212 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -72.05 -36.93 69.76 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.703 -177.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.33 -36.95 80.04 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.053 0.454 . . . . 0.0 110.758 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -79.61 -18.31 51.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.87 178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3607 ' ' GLN . . . . . 0.528 ' O ' ' HG ' ' A' 3555 ' ' LEU . 22.7 mt-30 51.92 48.31 23.02 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -171.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.492 ' O ' HD11 ' A' 3603 ' ' LEU . . . -130.24 -175.93 3.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.295 -171.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.762 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.71 117.73 28.24 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.499 175.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3610 ' ' GLY . . . . . 0.438 ' N ' HD12 ' A' 3603 ' ' LEU . . . -66.21 105.4 1.27 Allowed Glycine 0 C--O 1.222 -0.641 0 C-N-CA 120.837 -0.696 . . . . 0.0 111.896 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.649 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 35.4 mm -89.69 125.91 42.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.223 0.535 . . . . 0.0 111.22 -175.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' 3547 ' ' LEU . 28.1 mt -121.23 114.72 44.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.302 178.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.525 ' HA ' ' O ' ' A' 3624 ' ' TYR . 12.9 m120 -88.74 127.96 35.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.359 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.607 HG11 ' O ' ' A' 3537 ' ' SER . 4.8 t . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.187 -177.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.525 ' O ' ' HA ' ' A' 3613 ' ' ASN . 72.7 m-85 . . . . . 0 CA--C 1.513 -0.473 0 CA-C-O 121.044 0.449 . . . . 0.0 110.506 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.412 HG13 HD11 ' A' 3611 ' ' ILE . 4.3 t -126.67 114.07 36.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.851 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.6 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -98.42 114.88 27.4 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 169.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.508 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 65.4 mt-30 -94.5 110.92 22.68 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.59 HG12 HG12 ' A' 3659 ' ' ILE . 39.2 mt -92.38 98.7 8.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.279 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -88.55 142.59 31.2 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.917 177.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.5 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 48.2 Cg_endo -68.98 172.96 10.96 Favored 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 122.578 2.185 . . . . 0.0 111.308 176.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.35 45.23 0.51 Allowed 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.078 2.519 . . . . 0.0 112.276 176.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.7 p -84.39 163.35 19.57 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.982 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -42.62 -49.85 5.47 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 123.959 0.787 . . . . 0.0 112.02 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3634 ' ' PHE . . . . . 0.503 ' HB2' HD12 ' A' 3560 ' ' LEU . 38.6 t80 -50.82 -48.12 59.82 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 123.339 0.399 . . . . 0.0 111.487 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3635 ' ' SER . . . . . 0.418 ' HA ' ' HE1' ' A' 3658 ' ' MET . 9.7 m -68.15 -58.43 4.47 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.629 -176.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -60.93 -41.15 95.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.427 -173.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 9.0 t -66.19 -44.97 82.42 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 120.927 0.394 . . . . 0.0 110.243 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 19.7 m80 -68.87 -30.13 68.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.629 178.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 68.9 mt -66.01 -40.66 91.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.846 175.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.457 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 32.7 t -67.1 -25.55 66.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.15 0.5 . . . . 0.0 110.181 177.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -83.86 -38.6 20.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.189 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.582 HD13 HD22 ' A' 3575 ' ' LEU . 12.7 mt -94.91 -31.4 13.69 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -172.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.421 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -149.08 75.27 9.82 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -175.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -67.91 -18.75 46.77 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.788 2.325 . . . . 0.0 111.782 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3645 ' ' ASP . . . . . 0.537 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 2.7 m-20 -71.11 -49.95 38.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.196 -177.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.733 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -83.05 -29.11 29.1 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.444 178.818 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.457 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.35 -43.83 71.64 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.97 0.414 . . . . 0.0 110.45 179.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -67.14 -18.46 65.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.233 -0.44 . . . . 0.0 112.098 -176.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 89.1 p -91.49 -26.19 18.92 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.227 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.556 ' HA ' HG22 ' A' 3653 ' ' ILE . 7.1 pt -88.07 -10.44 10.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.558 -177.03 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.2 p -58.58 -23.93 59.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.875 175.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 5.3 t30 -85.9 -36.51 19.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.094 0.473 . . . . 0.0 110.206 175.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.556 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.4 tp -104.47 38.95 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 122.379 1.085 . . . . 0.0 109.789 -178.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.443 ' N ' ' HD2' ' A' 3655 ' ' PRO . 50.7 m -36.78 -42.24 0.81 Allowed Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 114.157 -1.383 . . . . 0.0 113.947 170.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.443 ' HD2' ' N ' ' A' 3654 ' ' SER . 12.9 Cg_endo -59.75 77.44 0.06 OUTLIER 'Trans proline' 0 C--N 1.357 1.008 0 C-N-CA 121.533 1.489 . . . . 0.0 111.517 168.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3656 ' ' HIS . . . . . 0.486 ' HB2' HD22 ' A' 3579 ' ' LEU . 22.5 p80 -147.69 174.89 11.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.776 -177.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.579 HD12 HD12 ' A' 3595 ' ' LEU . 42.9 mt -120.76 149.85 41.91 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.525 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3658 ' ' MET . . . . . 0.418 ' HE1' ' HA ' ' A' 3635 ' ' SER . 16.2 tmm? -113.98 114.54 26.31 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 174.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.59 HG12 HG12 ' A' 3628 ' ' ILE . 74.8 mt -108.38 121.22 61.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.169 0.509 . . . . 0.0 111.811 -170.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.79 HG13 ' HD2' ' A' 3573 ' ' TYR . 76.1 t -105.34 114.77 45.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.918 -178.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.6 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.5 mt -91.15 118.45 36.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.314 178.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.5 127.66 55.77 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.654 0.264 . . . . 0.0 110.615 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A 3663 ' ' SER . . . . . 0.455 ' HB2' HD21 ' A' 3533 ' ' LEU . 33.6 t -91.73 122.35 34.2 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.41 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 C--O 1.251 1.154 0 CA-C-O 117.337 -1.316 . . . . 0.0 112.693 178.221 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.571 ' CD1' ' HB2' ' A' 3553 ' ' MET . 8.9 m-85 . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 111.619 0.229 . . . . 0.0 111.619 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.604 ' O ' ' HG2' ' A' 3551 ' ' GLN . 4.5 tt0 58.44 -155.81 0.34 Allowed 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B 2520 ' ' THR . . . . . 0.595 ' H ' ' CG ' ' B' 2519 ' ' GLU . 58.5 m -155.07 121.87 5.42 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 175.248 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.567 ' HG ' ' OH ' ' A' 3602 ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.563 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp . . . . . 0 C--O 1.227 -0.086 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.646 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -69.4 -15.32 63.27 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.131 0.491 . . . . 0.0 110.163 -172.582 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.646 ' N ' HD12 ' A' 3502 ' ' LEU . 21.6 tptm -77.9 -25.92 48.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3504 ' ' LYS . . . . . 0.487 ' HG3' ' OD2' ' A' 3645 ' ' ASP . 31.5 mmtp -89.44 -43.14 11.07 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.706 175.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.725 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -153.74 104.17 2.51 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.18 179.598 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -84.01 174.12 8.58 Favored 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 124.085 3.19 . . . . 0.0 114.091 -174.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.503 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.8 mt -71.39 135.69 27.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.115 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 27.7 m -104.75 -29.57 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.292 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.677 ' HE3' HD12 ' A' 3524 ' ' LEU . 45.4 t90 -150.02 155.36 39.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -150.9 127.12 10.57 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . 177.93 -125.81 1.03 Allowed Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.539 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.646 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.3 mp -141.01 158.54 43.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.089 0.471 . . . . 0.0 111.098 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.495 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 79.7 mt -112.05 152.55 28.07 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 169.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.609 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.85 123.31 12.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.802 0.334 . . . . 0.0 111.836 -177.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.817 HD13 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.42 142.12 39.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 172.957 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.817 ' CD ' HD13 ' A' 3515 ' ' LEU . 0.5 OUTLIER 60.4 -91.6 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 122.788 0.435 . . . . 0.0 110.034 -171.385 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 45.7 m-80 -142.98 7.04 1.6 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.16 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -99.73 138.04 37.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.714 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.447 HG21 ' HB1' ' A' 3514 ' ' ALA . 15.3 p -128.86 127.82 42.63 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.748 -177.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -119.96 120.88 37.64 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.745 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.605 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -75.48 117.05 16.86 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.414 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 30.2 m -129.95 148.36 33.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.417 0.627 . . . . 0.0 111.974 -174.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -110.29 128.71 55.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.259 -0.882 . . . . 0.0 108.872 172.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.677 HD12 ' HE3' ' A' 3509 ' ' TRP . 1.5 mt -95.6 113.02 24.62 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.186 -174.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.515 ' CE1' HD11 ' A' 3579 ' ' LEU . 70.2 m80 -88.45 141.79 28.25 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.785 175.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.725 ' O ' ' HB2' ' A' 3505 ' ' TYR . 64.3 t80 -71.77 139.71 49.15 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 172.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.634 ' CG1' HD22 ' A' 3575 ' ' LEU . 21.4 t -115.23 -57.59 3.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.461 0.648 . . . . 0.0 110.719 176.081 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.517 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 68.9 m -159.42 171.77 19.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.175 -171.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.57 -149.06 20.33 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.792 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.485 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.4 t-20 -104.64 110.55 22.91 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.211 0.204 . . . . 0.0 110.664 -177.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.9 p30 -63.17 -30.93 71.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.538 -176.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 19.1 t -59.92 -33.47 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.88 0.372 . . . . 0.0 110.028 -179.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' 3530 ' ' ASN . 17.8 mt -56.71 -48.33 77.96 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.235 175.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.437 ' HA ' HD11 ' A' 3661 ' ' ILE . . . -65.13 -38.23 89.95 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.413 0.625 . . . . 0.0 110.23 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -62.52 -40.21 96.03 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.27 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -89.38 -10.01 48.19 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.416 ' HB2' HD13 ' A' 3626 ' ' LEU . 29.8 p -98.9 -41.82 7.43 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 122.015 -0.428 . . . . 0.0 111.506 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.558 HD11 ' HB2' ' A' 3509 ' ' TRP . 29.8 mt -78.84 111.27 18.4 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-O 121.142 0.496 . . . . 0.0 110.063 -173.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 N--CA 1.46 -0.445 0 C-N-CA 123.078 2.519 . . . . 0.0 112.474 -172.974 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 3546 ' ' PRO . . . . . 0.646 ' HA ' ' O ' ' A' 3512 ' ' LEU . 33.8 Cg_endo . . . . . 0 N--CA 1.462 -0.338 0 CA-C-O 120.922 0.301 . . . . 0.0 112.52 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.586 ' HB3' HD12 ' A' 3612 ' ' ILE . 24.4 mt -69.05 115.42 8.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.795 174.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.609 ' HA ' ' O ' ' A' 3514 ' ' ALA . 20.0 ptt180 -90.31 138.64 31.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.06 -176.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.493 ' CG2' HD12 ' B' 2521 ' ' LEU . 20.8 mt -95.26 106.96 18.87 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 CA-C-O 122.152 0.977 . . . . 0.0 110.865 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.463 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.38 -2.05 14.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.581 -1.191 . . . . 0.0 111.695 -173.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.687 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 16.1 mt-30 -151.13 174.44 13.21 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.459 0.171 . . . . 0.0 111.331 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.742 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -157.0 136.43 12.15 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.357 -177.874 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.565 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 11.7 tmm? -110.03 121.11 44.48 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.288 177.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3554 ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' 3554 ' ' ARG . 9.3 mmt180 -63.3 111.35 2.23 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.529 ' O ' HD12 ' A' 3555 ' ' LEU . 2.9 pp -71.84 97.32 1.79 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 122.472 1.13 . . . . 0.0 108.683 178.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' 3560 ' ' LEU . 6.0 mm-40 -103.9 163.86 12.08 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.498 -177.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.506 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -58.45 -45.89 87.66 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.224 0.328 . . . . 0.0 110.18 176.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 44.8 p -66.07 -41.86 90.17 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.107 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.562 ' O ' HG22 ' A' 3563 ' ' VAL . 15.4 mm100 -63.45 -49.71 72.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.13 -179.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.521 HD22 ' HB2' ' A' 3555 ' ' LEU . 79.7 mt -59.69 -37.51 79.02 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.512 -176.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' 3557 ' ' ALA . 7.4 mm-40 -56.58 -53.35 58.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.961 0.41 . . . . 0.0 110.06 175.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -60.89 -41.11 99.15 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.199 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.562 HG22 ' O ' ' A' 3559 ' ' GLN . 91.9 t -60.52 -52.78 57.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.448 0.166 . . . . 0.0 110.635 178.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.5 91.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.787 0.327 . . . . 0.0 111.293 -178.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.534 ' O ' HG23 ' A' 3568 ' ' THR . 98.1 mtt180 -68.05 -27.26 66.37 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.595 -177.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -88.42 -20.08 25.71 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.229 -0.588 . . . . 0.0 110.503 172.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.476 ' HE1' HD12 ' A' 3575 ' ' LEU . 76.8 mtp -74.69 -21.5 59.36 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.739 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3568 ' ' THR . . . . . 0.534 HG23 ' O ' ' A' 3565 ' ' ARG . 5.6 t -74.88 -7.32 53.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.113 0.483 . . . . 0.0 110.253 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.7 t -105.34 87.93 1.13 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.556 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.149 177.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -73.53 108.16 6.22 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.485 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.4 m 155.04 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.536 1.535 . . . . 0.0 107.811 -174.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -84.69 -24.96 28.73 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.934 -178.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.676 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.1 OUTLIER -130.16 161.52 30.93 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.053 179.616 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.598 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 47.8 t -124.84 135.83 53.26 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 171.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.634 HD22 ' CG1' ' A' 3527 ' ' VAL . 13.3 tp -105.61 125.55 51.11 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.532 HD13 HD23 ' A' 3524 ' ' LEU . 76.8 mt -125.57 153.44 43.69 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.143 0.497 . . . . 0.0 110.951 -177.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.599 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -121.94 106.39 11.19 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.47 ' HB2' HD11 ' A' 3659 ' ' ILE . . . -94.44 123.99 38.19 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.365 0.602 . . . . 0.0 110.24 -177.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.515 HD11 ' CE1' ' A' 3525 ' ' HIS . 79.1 mt -125.48 143.33 44.41 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.162 -178.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -61.36 113.33 1.73 Allowed 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.406 2.07 . . . . 0.0 111.637 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 28.0 p -100.89 111.69 23.96 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.096 0.474 . . . . 0.0 110.431 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.07 146.08 16.23 Favored Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.727 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -60.61 -35.82 77.07 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-O 121.344 0.592 . . . . 0.0 110.92 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.565 ' O ' HG21 ' A' 3588 ' ' VAL . 28.1 t70 -140.44 169.54 17.47 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -53.59 -39.85 65.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 118.003 0.365 . . . . 0.0 111.181 -178.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -63.39 -44.6 94.24 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.202 0.525 . . . . 0.0 110.603 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 12.6 t70 -63.34 -39.73 95.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.908 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.565 HG21 ' O ' ' A' 3584 ' ' ASP . 84.9 t -60.08 -41.48 86.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.945 178.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 4.9 t -62.59 -50.34 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 CA-C-O 121.555 0.693 . . . . 0.0 109.744 -178.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 37.1 m -59.84 -41.76 92.11 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 114.391 -1.277 . . . . 0.0 111.555 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -68.63 -38.23 80.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.48 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3592 ' ' THR . . . . . 0.443 ' O ' ' HG3' ' A' 3596 ' ' LYS . 86.6 m -58.55 -54.74 43.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.933 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -65.24 -33.4 75.9 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.965 -0.294 . . . . 0.0 111.2 -177.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 66.7 m -63.8 -45.94 87.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.421 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.578 HD12 HD12 ' A' 3657 ' ' LEU . 57.6 tp -62.95 -40.7 98.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.471 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.511 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 55.1 mtpt -58.74 -59.43 5.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.888 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.63 -29.53 69.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -174.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -95.64 -47.68 6.11 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -173.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.498 ' HB2' HD13 ' A' 3595 ' ' LEU . 23.5 m-85 -100.72 -50.26 3.92 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -174.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.511 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.4 mm -62.35 -58.59 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.893 -175.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 32.5 m -59.63 -31.61 69.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.237 -178.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.813 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.1 OUTLIER -72.62 -58.61 3.23 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.812 177.752 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.813 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.37 -42.54 78.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.567 0.223 . . . . 0.0 111.56 -178.161 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -69.85 -38.15 76.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.6 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.22 -40.17 74.7 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.009 0.433 . . . . 0.0 110.499 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -73.98 -19.05 60.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.001 178.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3607 ' ' GLN . . . . . 0.489 ' O ' ' HG ' ' A' 3555 ' ' LEU . 23.5 mt-30 48.72 52.46 13.93 Favored 'General case' 0 C--O 1.23 0.068 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 -169.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.431 ' O ' HD13 ' A' 3603 ' ' LEU . . . -130.96 -175.96 3.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.978 -0.556 . . . . 0.0 112.197 -173.055 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.742 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.92 117.47 27.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.306 175.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.39 103.73 0.79 Allowed Glycine 0 C--O 1.222 -0.653 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.338 178.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.687 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.4 mm -89.28 120.23 37.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.207 0.527 . . . . 0.0 111.377 -173.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.586 HD12 ' HB3' ' A' 3547 ' ' LEU . 30.5 mt -122.53 105.29 15.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.825 175.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.521 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.8 m120 -83.65 125.06 31.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.866 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 34.5 m . . . . . 0 C--N 1.32 -0.702 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.443 178.929 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.521 ' O ' ' HA ' ' A' 3613 ' ' ASN . 79.3 m-85 . . . . . 0 CA--C 1.51 -0.59 0 CA-C-O 120.829 0.347 . . . . 0.0 110.492 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.488 HG12 HG21 ' A' 3611 ' ' ILE . 9.9 t -122.74 115.75 46.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.237 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.644 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -95.55 110.03 22.17 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 170.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.485 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 61.5 mt-30 -94.5 110.74 22.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.692 -177.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.585 HG12 HG12 ' A' 3659 ' ' ILE . 31.6 mt -89.75 98.27 7.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.126 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -87.54 144.5 35.61 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.875 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.644 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 58.8 Cg_endo -71.7 170.18 19.3 Favored 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.576 2.184 . . . . 0.0 111.404 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3631 ' ' PRO . . . . . 0.416 ' HD3' ' O ' ' A' 3656 ' ' HIS . 36.9 Cg_endo -67.96 77.61 0.59 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.362 2.041 . . . . 0.0 110.969 174.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.543 ' O ' ' HG2' ' A' 3636 ' ' GLU . 8.4 p -111.95 162.77 14.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.297 -171.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -48.84 -39.28 24.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.993 176.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 46.6 t80 -58.18 -55.95 28.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.231 176.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 33.8 p -66.23 -54.16 28.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.481 -174.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3636 ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.8 mm-40 -61.32 -35.15 76.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.795 -171.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 45.8 m -71.87 -46.0 59.38 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.058 0.456 . . . . 0.0 110.554 -178.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -63.32 -35.67 81.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.148 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.46 -32.9 74.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.031 176.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3640 ' ' SER . . . . . 1.053 ' HA ' HD21 ' A' 3647 ' ' LEU . 17.5 t -65.32 -35.76 81.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 0.0 110.08 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.97 -54.71 5.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.012 177.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.598 HD12 HD21 ' A' 3575 ' ' LEU . 28.2 mt -67.23 -39.62 86.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.463 -0.789 . . . . 0.0 112.821 -171.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.408 ' CB ' HG11 ' A' 3527 ' ' VAL . . . -147.61 75.24 11.24 Favored Pre-proline 0 C--N 1.327 -0.385 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3644 ' ' PRO . . . . . 0.436 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 48.9 Cg_endo -69.52 -19.9 36.65 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.412 2.075 . . . . 0.0 111.752 178.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3645 ' ' ASP . . . . . 0.487 ' OD2' ' HG3' ' A' 3504 ' ' LYS . 43.6 m-20 -70.68 -51.66 26.22 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.026 -177.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.599 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -79.52 -28.01 41.35 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 1.053 HD21 ' HA ' ' A' 3640 ' ' SER . 25.4 tp -52.06 -48.47 64.61 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.618 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.88 -20.33 63.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.492 -176.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 8.3 t -89.58 -33.56 16.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.175 178.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.513 HG12 ' HA ' ' A' 3647 ' ' LEU . 6.3 pt -80.81 -16.78 12.44 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.849 179.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 6.1 t -59.88 -21.14 60.62 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.41 0.624 . . . . 0.0 109.685 174.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -88.14 -39.21 14.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.353 174.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.505 HD12 ' HG2' ' A' 3655 ' ' PRO . 8.3 tp -105.22 43.15 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 122.461 1.124 . . . . 0.0 109.439 -179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.474 ' N ' ' HD2' ' A' 3655 ' ' PRO . 20.3 m -37.19 -42.97 1.06 Allowed Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 113.98 -1.464 . . . . 0.0 113.524 172.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.505 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.8 Cg_endo -60.22 82.43 0.07 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.432 1.421 . . . . 0.0 111.661 168.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3656 ' ' HIS . . . . . 0.416 ' O ' ' HD3' ' A' 3631 ' ' PRO . 25.7 p80 -148.18 174.64 11.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.145 -177.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.578 HD12 HD12 ' A' 3595 ' ' LEU . 39.1 mt -120.96 150.34 41.26 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.446 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 59.2 ttp -111.82 109.65 19.59 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 173.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.585 HG12 HG12 ' A' 3628 ' ' ILE . 83.5 mt -101.31 114.76 41.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 121.248 0.547 . . . . 0.0 111.19 -173.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.676 HG12 ' HD2' ' A' 3573 ' ' TYR . 72.4 t -101.1 114.54 40.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.799 -177.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.644 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.0 mt -90.51 112.09 24.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -117.12 129.21 55.82 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 120.882 0.372 . . . . 0.0 111.621 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 27.9 m -103.02 108.45 19.63 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 169.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.328 179.36 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.565 ' CD1' ' HB2' ' A' 3553 ' ' MET . 31.0 m-85 . . . . . 0 N--CA 1.482 1.134 0 CA-C-O 119.745 -0.169 . . . . 0.0 111.408 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.519 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.5 OUTLIER 53.49 -155.54 0.21 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.761 0.791 . . . . 0.0 111.419 179.143 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 98.5 m -153.14 123.22 6.98 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.577 -1.192 . . . . 0.0 107.996 167.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.493 HD12 ' CG2' ' A' 3549 ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.343 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -177.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.557 HD11 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp . . . . . 0 CA--C 1.53 0.183 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.677 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -69.82 -15.81 63.17 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.557 0.617 . . . . 0.0 110.243 -172.363 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.594 ' N ' HD12 ' A' 3502 ' ' LEU . 28.2 mtpp -68.21 -24.73 64.97 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.2 175.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3504 ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 28.4 mmtp -101.59 -42.56 6.18 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.232 176.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.737 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -144.3 99.35 4.96 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-O 121.503 0.668 . . . . 0.0 110.533 179.414 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 3506 ' ' PRO . . . . . 0.677 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 92.6 Cg_endo -83.52 173.04 9.88 Favored 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 124.128 3.219 . . . . 0.0 113.958 -174.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.494 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 82.0 mt -73.64 138.6 20.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.394 -177.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 23.1 m -108.58 -31.42 2.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.217 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.795 ' CD1' HD11 ' A' 3524 ' ' LEU . 2.2 t-105 -138.75 148.84 44.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.391 -177.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -146.59 119.2 8.53 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 170.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3511 ' ' GLY . . . . . 0.452 ' O ' ' HA ' ' A' 3521 ' ' ALA . . . 177.97 -129.81 1.49 Allowed Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -175.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.579 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 4.9 mp -139.76 153.6 47.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.504 0.652 . . . . 0.0 111.931 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' 3519 ' ' THR . 69.1 mt -106.15 154.12 21.13 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 167.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.664 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -142.83 121.86 12.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 117.97 0.35 . . . . 0.0 111.829 -177.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.64 HD13 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.34 147.09 41.08 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 172.797 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.64 ' HD3' HD13 ' A' 3515 ' ' LEU . 0.8 OUTLIER 63.57 -99.25 0.07 Allowed 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -170.11 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -139.39 5.79 2.28 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.694 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 1.6 t0 -103.23 139.05 39.2 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.815 -172.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.515 HG22 ' HB2' ' A' 3514 ' ' ALA . 14.7 p -122.65 127.94 49.98 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.896 -177.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -115.74 115.51 26.46 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.602 177.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.579 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.01 112.67 6.57 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 121.299 0.571 . . . . 0.0 109.634 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.419 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 30.9 m -127.36 147.64 32.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.678 -176.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3523 ' ' GLN . . . . . 0.428 ' HG3' ' CE1' ' A' 3525 ' ' HIS . 20.2 pt20 -107.48 124.3 49.68 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.018 173.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.795 HD11 ' CD1' ' A' 3509 ' ' TRP . 4.8 mt -94.52 113.14 24.94 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.626 -176.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.494 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 56.5 m80 -91.03 142.6 27.6 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.688 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.737 ' O ' ' HB2' ' A' 3505 ' ' TYR . 60.0 t80 -70.02 137.31 51.24 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 172.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.617 ' CG1' HD22 ' A' 3575 ' ' LEU . 22.1 t -115.31 -55.8 4.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-O 121.383 0.611 . . . . 0.0 110.86 176.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.488 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 69.7 m -161.41 172.43 16.52 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.138 -171.253 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 84.51 -153.13 28.46 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.512 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.541 ' HB2' ' HA ' ' A' 3571 ' ' THR . 31.1 t30 -99.46 111.23 23.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.579 0.228 . . . . 0.0 111.102 -177.093 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -61.83 -29.02 69.89 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.313 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 98.7 t -58.79 -34.23 51.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.545 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.526 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 57.1 mt -59.3 -42.4 91.23 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.111 178.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.52 89.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.916 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -59.1 -38.72 80.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.166 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 9.0 ptm85 -88.5 -18.61 27.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -176.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.497 ' HB2' HD13 ' A' 3626 ' ' LEU . 43.9 p -92.27 -40.24 11.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.911 0.386 . . . . 0.0 111.193 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.553 HD12 ' HB2' ' A' 3509 ' ' TRP . 34.3 mt -79.39 120.98 82.29 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-O 121.108 0.48 . . . . 0.0 110.024 -174.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo . . . . . 0 CA--C 1.53 0.323 0 C-N-CA 123.429 2.752 . . . . 0.0 112.503 -177.116 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo . . . . . 0 C--O 1.233 0.272 0 N-CA-C 111.276 -0.317 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.539 ' HB3' HD12 ' A' 3612 ' ' ILE . 36.9 mt -68.24 108.49 3.2 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.664 ' HA ' ' O ' ' A' 3514 ' ' ALA . 19.3 ptt180 -97.41 138.48 34.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.056 0.455 . . . . 0.0 111.301 -175.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.446 HD12 HD23 ' A' 3515 ' ' LEU . 18.9 mt -91.15 106.68 17.82 Favored 'Isoleucine or valine' 0 C--O 1.247 0.938 0 CA-C-O 122.068 0.937 . . . . 0.0 111.105 -175.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.471 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.5 -1.45 14.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.81 -173.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.646 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 39.9 mt-30 -148.1 173.21 13.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.41 0.148 . . . . 0.0 110.863 177.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.606 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -150.91 140.91 22.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.004 0.431 . . . . 0.0 111.402 -179.686 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.529 ' O ' ' HA ' ' A' 3608 ' ' ALA . 21.7 ttt -109.53 124.93 51.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.089 178.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -64.58 110.04 2.19 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.55 ' O ' HD12 ' A' 3555 ' ' LEU . 3.6 pp -79.24 97.57 6.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 118.559 -1.256 . . . . 0.0 108.605 176.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.538 ' O ' ' HG ' ' A' 3560 ' ' LEU . 44.9 mt-10 -118.07 164.03 15.73 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.471 -1.24 . . . . 0.0 109.225 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.471 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -49.99 -53.69 24.95 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.394 0.434 . . . . 0.0 111.52 -178.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 23.5 p -64.51 -39.81 94.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.482 -178.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.549 ' O ' HG21 ' A' 3563 ' ' VAL . 15.0 mm100 -66.75 -40.19 88.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.973 -179.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' 3556 ' ' GLU . 92.1 mt -61.19 -34.54 75.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.816 179.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.543 ' O ' ' HD3' ' A' 3565 ' ' ARG . 7.9 mm-40 -60.19 -49.67 76.69 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 174.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.58 -41.42 99.57 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.702 178.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.549 HG21 ' O ' ' A' 3559 ' ' GLN . 57.7 t -60.43 -44.77 96.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.731 0.301 . . . . 0.0 110.28 177.37 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -57.2 -36.82 71.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.394 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.543 ' HD3' ' O ' ' A' 3561 ' ' GLU . 10.5 mpt_? -58.31 -45.15 88.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.735 -0.211 . . . . 0.0 111.506 179.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3566 ' ' ARG . . . . . 0.418 ' HG2' ' O ' ' A' 3563 ' ' VAL . 18.8 ptp180 -78.77 -16.34 57.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.861 0.362 . . . . 0.0 110.452 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.495 ' HE2' HD13 ' A' 3575 ' ' LEU . 80.8 mtp -85.45 -22.01 28.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.575 0.702 . . . . 0.0 109.92 176.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 1.4 m -74.82 -23.46 58.47 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.26 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 39.7 t -98.01 87.76 1.64 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.358 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -74.23 107.72 6.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.541 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.6 m 150.57 -44.76 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.436 1.494 . . . . 0.0 107.769 -172.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.61 -31.1 24.45 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.832 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.853 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -119.62 158.93 25.39 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.213 0.53 . . . . 0.0 109.777 177.395 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.56 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 42.2 t -122.4 136.87 54.98 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 170.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.617 HD22 ' CG1' ' A' 3527 ' ' VAL . 14.2 tp -104.81 125.69 51.12 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.526 ' HB3' HD21 ' A' 3524 ' ' LEU . 70.6 mt -126.35 154.7 43.16 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.546 -177.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.664 ' HG ' HD13 ' A' 3646 ' ' LEU . 0.4 OUTLIER -122.08 107.03 11.72 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.099 179.697 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.501 ' HB1' HD11 ' A' 3659 ' ' ILE . . . -94.14 120.25 34.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.489 0.662 . . . . 0.0 110.356 -178.403 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.543 ' HG ' HD13 ' A' 3577 ' ' LEU . 57.8 mt -122.18 146.34 46.49 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.791 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.23 116.9 3.56 Favored 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.145 1.897 . . . . 0.0 111.551 176.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 30.3 p -104.43 117.07 33.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.117 0.484 . . . . 0.0 109.97 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3582 ' ' GLY . . . . . 0.483 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.42 138.59 14.08 Favored Glycine 0 N--CA 1.437 -1.271 0 C-N-CA 120.262 -0.971 . . . . 0.0 111.82 178.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3583 ' ' ARG . . . . . 0.48 ' HG3' ' OD2' ' A' 3587 ' ' ASP . 33.0 mtt85 -70.24 -30.46 67.53 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.706 0.765 . . . . 0.0 109.093 177.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.487 ' O ' HG21 ' A' 3588 ' ' VAL . 3.9 p30 -140.04 174.57 10.39 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.956 178.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -60.47 -40.73 92.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.825 0.345 . . . . 0.0 111.115 -175.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3586 ' ' GLU . . . . . 0.402 ' HB3' ' OD1' ' A' 3584 ' ' ASP . 35.0 tt0 -67.19 -44.41 79.7 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.057 0.456 . . . . 0.0 109.922 178.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.48 ' OD2' ' HG3' ' A' 3583 ' ' ARG . 5.5 t70 -55.98 -45.68 78.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.58 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.487 HG21 ' O ' ' A' 3584 ' ' ASP . 74.1 t -55.26 -54.7 22.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.828 178.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 82.1 t -58.4 -46.75 89.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.353 -178.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 46.9 t -60.54 -49.8 76.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.198 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -67.36 -30.34 70.11 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -177.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 83.2 m -61.92 -48.21 81.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.998 0.428 . . . . 0.0 110.026 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.9 -46.31 71.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.25 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 19.3 m -55.45 -47.51 75.93 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.517 178.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.558 HD13 HD12 ' A' 3657 ' ' LEU . 65.3 tp -63.57 -41.91 98.35 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.01 0.433 . . . . 0.0 110.332 176.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.59 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 1.9 ttmt -61.18 -50.12 74.45 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.011 -179.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3597 ' ' ALA . . . . . 0.413 ' N ' ' HG2' ' A' 3596 ' ' LYS . . . -73.66 -35.78 65.27 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -179.266 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.524 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -90.49 -46.35 8.38 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -171.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.623 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 11.6 m-85 -99.58 -50.0 4.22 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.822 0.344 . . . . 0.0 111.387 -175.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.59 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 28.5 mm -62.12 -58.69 6.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.735 -176.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 59.2 m -57.75 -38.54 75.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.247 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.685 ' CE2' HD21 ' A' 3603 ' ' LEU . 0.0 OUTLIER -67.72 -53.13 29.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.749 0.309 . . . . 0.0 110.627 179.277 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.685 HD21 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -69.21 -34.53 75.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.148 -170.225 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -70.58 -36.82 73.78 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.45 -37.71 74.36 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.816 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3606 ' ' LYS . . . . . 0.565 ' HG2' ' O ' ' A' 3602 ' ' TYR . 72.4 mmtt -73.56 -19.51 60.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.703 178.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3607 ' ' GLN . . . . . 0.444 ' O ' ' HG ' ' A' 3555 ' ' LEU . 74.6 mt-30 48.95 50.68 17.39 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -169.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.529 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -132.92 170.67 15.0 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.245 -172.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.606 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -105.27 118.15 35.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.258 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.68 105.89 1.3 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.336 177.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.646 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 34.4 mm -90.02 122.1 41.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-O 121.22 0.533 . . . . 0.0 111.181 -174.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.539 HD12 ' HB3' ' A' 3547 ' ' LEU . 32.4 mt -120.84 117.08 51.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.702 175.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 14.9 m120 -95.42 126.01 40.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.356 -176.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 32.1 m . . . . . 0 C--N 1.32 -0.681 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.351 177.927 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 3624 ' ' TYR . . . . . . . . . . . . . 57.5 m-85 . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 121.136 0.493 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.493 HG13 ' HG3' ' A' 3627 ' ' GLN . 2.8 t -124.23 118.01 52.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.059 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.623 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -96.28 111.3 23.41 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 171.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.512 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 76.2 mt-30 -94.18 110.94 22.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.953 -178.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.577 HG12 HG12 ' A' 3659 ' ' ILE . 26.3 mt -92.94 99.46 9.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.356 -179.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -89.01 138.08 29.34 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.001 178.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.608 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 45.0 Cg_endo -68.05 168.83 17.91 Favored 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.639 2.226 . . . . 0.0 111.186 176.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -65.36 81.43 0.22 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.469 2.113 . . . . 0.0 111.673 177.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.537 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.9 p -113.24 162.6 15.82 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.523 -176.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -54.89 -35.81 64.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.832 0.349 . . . . 0.0 110.323 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 40.0 t80 -53.96 -53.59 50.77 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.114 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3635 ' ' SER . . . . . 0.41 ' O ' ' HG ' ' A' 3639 ' ' LEU . 49.9 p -69.92 -53.65 16.95 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.873 -177.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3636 ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' 3632 ' ' CYS . 20.6 mm-40 -61.12 -43.86 98.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.857 -172.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 41.6 t -66.56 -43.49 84.88 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.118 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 12.6 m80 -64.0 -36.22 83.27 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.544 176.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3639 ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' 3635 ' ' SER . 79.0 mt -64.93 -42.37 94.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.959 177.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.769 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 36.6 t -58.41 -35.13 71.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.267 0.556 . . . . 0.0 110.448 178.042 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -79.83 -50.24 10.8 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.823 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.567 HD13 HD21 ' A' 3575 ' ' LEU . 19.7 mt -75.31 -38.3 60.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.46 -171.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.516 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -146.54 87.56 6.4 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.806 0.336 . . . . 0.0 111.332 -179.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.66 -24.98 21.19 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.587 2.191 . . . . 0.0 113.712 -174.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 4.1 t70 -80.31 -40.28 27.1 Favored 'General case' 0 CA--C 1.513 -0.444 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.534 -171.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.664 HD13 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.82 -29.4 44.75 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 176.559 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.769 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.26 -44.64 71.99 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.046 176.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -59.37 -34.58 72.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.903 0.382 . . . . 0.0 111.067 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 18.9 m -71.15 -41.8 69.96 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.916 0.389 . . . . 0.0 110.684 177.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.544 ' HA ' ' CG2' ' A' 3653 ' ' ILE . 5.2 pt -79.59 -17.58 12.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.514 -173.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 48.8 m -57.74 -26.14 61.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.148 0.499 . . . . 0.0 110.441 174.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -87.4 -37.39 17.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.141 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.544 ' CG2' ' HA ' ' A' 3650 ' ' ILE . 8.2 tp -104.91 43.64 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 122.406 1.098 . . . . 0.0 109.198 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.48 ' N ' ' HD2' ' A' 3655 ' ' PRO . 7.7 t -37.63 -43.46 1.41 Allowed Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 114.003 -1.453 . . . . 0.0 113.22 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.489 ' HG2' HD11 ' A' 3653 ' ' ILE . 15.3 Cg_endo -59.16 87.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 121.437 1.425 . . . . 0.0 111.601 169.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -154.83 177.95 10.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.399 -177.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.558 HD12 HD13 ' A' 3595 ' ' LEU . 43.5 mt -126.78 133.47 50.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.658 -179.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.7 tmm? -99.69 112.56 24.79 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.59 HD11 HD23 ' A' 3524 ' ' LEU . 75.8 mt -108.93 120.86 61.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 121.331 0.586 . . . . 0.0 111.838 -170.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.853 HG13 ' HD2' ' A' 3573 ' ' TYR . 63.7 t -103.65 116.64 47.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.779 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.623 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.8 mt -90.69 111.78 24.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 176.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.51 128.68 56.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.781 0.324 . . . . 0.0 111.404 -176.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 14.8 m -77.66 119.82 21.74 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.885 173.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 52.6 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.677 -0.677 . . . . 0.0 109.713 177.72 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.471 ' CD2' ' HB2' ' A' 3553 ' ' MET . 42.4 m-85 . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 111.347 0.129 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.994 ' HG3' ' H ' ' B' 2520 ' ' THR . 6.7 tp10 58.0 -150.79 0.43 Allowed 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 177.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B 2520 ' ' THR . . . . . 0.994 ' H ' ' HG3' ' B' 2519 ' ' GLU . 33.7 m -154.98 126.59 7.44 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 174.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.517 HD13 ' HD2' ' A' 3552 ' ' ARG . 36.2 tp . . . . . 0 CA--C 1.515 -0.385 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.709 176.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.565 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp . . . . . 0 CA--C 1.532 0.277 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.621 HD11 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.38 -15.61 63.78 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.682 -173.929 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.621 ' N ' HD11 ' A' 3502 ' ' LEU . 23.3 ttmm -61.46 -38.42 87.17 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.063 0.459 . . . . 0.0 110.14 176.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3504 ' ' LYS . . . . . 0.545 ' HD2' ' CD2' ' A' 3505 ' ' TYR . 7.5 tmtt? -94.66 -41.96 9.02 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.735 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -144.4 100.89 4.77 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.375 -177.111 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 3506 ' ' PRO . . . . . 0.429 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 77.8 Cg_endo -87.61 173.43 5.33 Favored 'Trans proline' 0 CA--C 1.531 0.356 0 C-N-CA 124.257 3.304 . . . . 0.0 113.364 -179.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.5 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 85.9 mt -71.6 128.96 35.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.719 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3508 ' ' VAL . . . . . 0.438 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.0 m -98.48 -29.69 3.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.36 -178.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.563 ' CB ' HD13 ' A' 3538 ' ' LEU . 6.4 t-105 -153.57 158.16 40.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.21 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 25.1 tt0 -150.45 119.76 6.84 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 177.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.16 -132.56 1.41 Allowed Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.758 -0.734 . . . . 0.0 111.276 -176.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.608 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -139.85 153.21 46.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.056 0.455 . . . . 0.0 111.063 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.453 HD23 ' HB2' ' A' 3547 ' ' LEU . 73.7 mt -110.58 150.53 28.81 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 171.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.667 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.3 125.42 15.4 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -177.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.589 HD11 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.67 143.98 39.42 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 171.89 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.589 ' HD3' HD11 ' A' 3515 ' ' LEU . 0.2 OUTLIER 62.29 -94.94 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 -168.784 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 13.4 m120 -142.66 5.74 1.6 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.727 174.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.403 ' O ' ' HA ' ' A' 3514 ' ' ALA . 26.4 m-20 -92.96 136.18 33.49 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.964 0.412 . . . . 0.0 110.727 -175.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.445 HG22 ' HB1' ' A' 3514 ' ' ALA . 13.4 p -123.98 140.69 52.73 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.219 -177.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.41 115.65 14.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.12 176.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.608 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -69.7 118.63 12.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.212 0.529 . . . . 0.0 109.857 175.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 27.3 m -131.07 147.55 33.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.82 -176.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -105.59 125.74 51.34 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.036 173.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.623 HD21 HD12 ' A' 3576 ' ' LEU . 0.9 OUTLIER -95.24 108.17 20.31 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.805 -175.797 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.5 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 71.4 m-70 -83.75 140.97 31.76 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.678 174.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.735 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.4 t80 -68.6 140.58 55.56 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 172.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.627 ' CG1' HD21 ' A' 3575 ' ' LEU . 23.5 t -116.15 -53.06 4.58 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.373 0.606 . . . . 0.0 110.903 175.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.418 ' OG ' HD23 ' A' 3642 ' ' LEU . 39.4 t -162.38 170.81 18.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.268 -171.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.54 -147.83 20.19 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.885 176.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.558 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.8 t-20 -107.99 114.66 28.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.853 0.358 . . . . 0.0 110.845 -177.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -62.17 -32.37 72.98 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.811 -177.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3532 ' ' VAL . . . . . 0.518 ' O ' ' HG2' ' A' 3536 ' ' ARG . 45.4 t -60.06 -35.6 62.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.148 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.47 HD22 ' HD3' ' A' 3536 ' ' ARG . 16.9 mt -55.6 -40.24 71.79 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.404 177.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.478 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.31 -44.57 83.08 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.452 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 5.2 t60 -63.82 -32.49 74.02 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.049 -178.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3536 ' ' ARG . . . . . 0.518 ' HG2' ' O ' ' A' 3532 ' ' VAL . 10.8 ptm180 -88.62 -11.69 44.73 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.492 ' HB2' HD12 ' A' 3626 ' ' LEU . 34.2 p -103.92 -40.37 6.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 111.396 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.563 HD13 ' CB ' ' A' 3509 ' ' TRP . 16.7 mt -80.2 114.42 46.76 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -176.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo . . . . . 0 N--CA 1.457 -0.622 0 C-N-CA 122.174 1.916 . . . . 0.0 111.871 -179.316 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A 3546 ' ' PRO . . . . . 0.496 ' HA ' ' O ' ' A' 3512 ' ' LEU . 6.3 Cg_exo . . . . . 0 N--CA 1.457 -0.67 0 CA-C-O 121.005 0.336 . . . . 0.0 112.318 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.538 ' HB3' HD13 ' A' 3612 ' ' ILE . 42.7 mt -69.32 110.93 4.9 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.015 176.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.667 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -96.97 138.37 34.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.116 0.484 . . . . 0.0 111.103 -177.541 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.484 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.3 mt -87.93 112.38 23.5 Favored 'Isoleucine or valine' 0 C--O 1.242 0.666 0 CA-C-O 121.872 0.844 . . . . 0.0 111.422 -173.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.539 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -121.47 4.9 10.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.786 -174.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.707 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 48.8 mt-30 -152.23 173.06 15.46 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.63 177.081 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.734 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.47 139.41 11.76 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.855 0.359 . . . . 0.0 111.654 -179.478 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.585 ' HB2' ' CD2' ' B' 2518 ' ' TYR . 13.7 tmm? -111.92 120.11 40.79 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.076 176.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -68.55 110.01 4.01 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.587 HD11 ' O ' ' A' 3555 ' ' LEU . 2.5 pp -69.77 98.38 1.2 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 122.241 1.02 . . . . 0.0 110.006 -175.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.603 ' O ' ' HG ' ' A' 3560 ' ' LEU . 38.1 mm-40 -116.83 159.16 22.78 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.535 179.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -50.19 -50.13 50.29 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.321 0.388 . . . . 0.0 111.392 -177.149 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 5.9 p -63.28 -43.91 96.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.646 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.465 ' O ' HG22 ' A' 3563 ' ' VAL . 16.9 mm-40 -66.28 -38.97 89.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.302 -178.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' 3556 ' ' GLU . 87.4 mt -61.95 -35.02 77.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.568 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' 3557 ' ' ALA . 76.1 mm-40 -60.91 -47.17 87.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.951 174.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -59.49 -35.74 86.61 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.637 176.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.518 ' O ' ' HG3' ' A' 3567 ' ' MET . 60.2 t -67.5 -53.66 30.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.828 0.347 . . . . 0.0 110.208 176.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3564 ' ' ALA . . . . . 0.475 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.1 -26.58 66.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.489 -178.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -58.33 -40.25 81.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3566 ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' 3563 ' ' VAL . 12.0 ptp180 -88.38 -14.3 38.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.927 0.394 . . . . 0.0 110.791 177.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.518 ' HG3' ' O ' ' A' 3563 ' ' VAL . 88.1 mtp -79.03 -26.61 43.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.166 -178.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 8.5 t -74.99 -9.09 58.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.059 0.457 . . . . 0.0 110.644 -178.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 42.3 t -115.95 91.15 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.061 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -70.43 108.06 4.1 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 178.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.558 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.0 m 153.19 -46.22 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 O-C-N 125.046 1.466 . . . . 0.0 108.089 -173.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.31 -25.94 33.51 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.929 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.674 ' HD2' HG11 ' A' 3660 ' ' VAL . 0.1 OUTLIER -128.91 162.6 27.15 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.016 177.751 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.607 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 31.1 t -126.53 135.14 50.91 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.629 HD11 ' HE2' ' A' 3573 ' ' TYR . 13.3 tp -105.83 125.97 51.62 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.623 HD12 HD21 ' A' 3524 ' ' LEU . 67.7 mt -126.3 155.88 41.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.297 0.57 . . . . 0.0 111.035 -176.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.559 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -124.24 107.06 10.8 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.94 -179.689 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.437 ' HB2' HD11 ' A' 3659 ' ' ILE . . . -94.64 119.74 33.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.379 0.609 . . . . 0.0 110.346 -177.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.443 ' HG ' HD11 ' A' 3577 ' ' LEU . 74.5 mt -119.44 143.78 35.23 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.238 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.93 112.8 1.4 Allowed 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 122.429 2.086 . . . . 0.0 111.641 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 28.5 p -101.93 113.49 26.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.196 0.522 . . . . 0.0 110.517 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.85 145.43 16.12 Favored Glycine 0 N--CA 1.438 -1.175 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.967 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3583 ' ' ARG . . . . . 0.434 ' HE ' ' CG ' ' A' 3587 ' ' ASP . 45.6 mtm180 -71.69 -34.46 69.67 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.697 0.76 . . . . 0.0 109.962 178.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.527 ' O ' HG21 ' A' 3588 ' ' VAL . 14.5 t70 -133.35 165.97 23.61 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.192 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3585 ' ' GLN . . . . . 0.416 ' O ' HG21 ' A' 3589 ' ' VAL . 36.2 tt0 -53.82 -37.46 63.59 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.069 0.461 . . . . 0.0 110.299 176.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -65.99 -44.8 83.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.279 176.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.436 ' HB3' ' H ' ' A' 3584 ' ' ASP . 14.8 t70 -64.46 -41.02 96.76 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.633 -177.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.527 HG21 ' O ' ' A' 3584 ' ' ASP . 88.7 t -56.93 -48.0 82.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.321 178.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3589 ' ' VAL . . . . . 0.416 HG21 ' O ' ' A' 3585 ' ' GLN . 88.9 t -59.0 -47.34 90.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.391 178.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 22.4 t -62.53 -41.59 98.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.006 -179.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3591 ' ' GLN . . . . . 0.587 ' NE2' ' H ' ' A' 3521 ' ' ALA . 13.1 mm100 -67.95 -38.26 82.59 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 122.318 -0.239 . . . . 0.0 110.761 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3592 ' ' THR . . . . . 0.525 HG23 ' HE2' ' A' 3596 ' ' LYS . 44.9 m -62.6 -52.24 64.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.702 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3593 ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.6 pt-20 -62.71 -41.76 99.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.619 0.247 . . . . 0.0 111.146 -178.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.5 m -61.23 -46.64 89.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.852 0.358 . . . . 0.0 110.572 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.577 HD11 HD13 ' A' 3657 ' ' LEU . 50.3 tp -63.48 -42.55 98.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.762 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.552 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 57.7 mtmt -62.53 -45.53 92.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.506 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.03 -33.32 59.63 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.508 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -93.94 -46.65 7.07 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -172.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.707 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 21.4 m-85 -100.55 -50.93 3.74 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -176.214 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.552 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.0 mm -61.51 -60.9 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.276 -174.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 60.8 m -59.4 -40.59 87.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.3 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.707 ' HD2' ' HA ' ' A' 3599 ' ' PHE . 0.0 OUTLIER -65.04 -50.38 66.45 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.838 0.351 . . . . 0.0 110.835 -179.726 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.69 HD21 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -70.36 -36.05 73.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.911 -170.528 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -75.78 -29.17 58.68 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.942 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.31 -40.34 77.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.122 0.486 . . . . 0.0 110.175 176.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -73.46 -19.1 61.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.266 177.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3607 ' ' GLN . . . . . 0.442 ' O ' ' HG ' ' A' 3555 ' ' LEU . 46.4 mt-30 46.97 58.31 4.89 Favored 'General case' 0 C--O 1.232 0.161 0 O-C-N 123.815 0.697 . . . . 0.0 109.139 -168.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.422 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -140.88 174.59 10.37 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.38 0.61 . . . . 0.0 112.214 -172.194 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.734 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -108.28 117.54 34.43 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.453 174.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -65.34 103.73 0.85 Allowed Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 176.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.707 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 29.8 mm -89.32 123.37 41.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 121.374 0.607 . . . . 0.0 110.902 -174.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.538 HD13 ' HB3' ' A' 3547 ' ' LEU . 48.0 mt -120.82 111.92 33.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.179 174.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 6.6 m120 -88.84 136.18 33.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.872 -175.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.491 ' HB ' ' HB2' ' A' 3624 ' ' TYR . 46.1 t . . . . . 0 C--N 1.321 -0.636 0 CA-C-O 120.766 0.317 . . . . 0.0 110.193 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.491 ' HB2' ' HB ' ' A' 3614 ' ' VAL . 64.6 m-85 . . . . . 0 CA--C 1.517 -0.313 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.441 HG11 HD12 ' A' 3611 ' ' ILE . 2.9 t -130.68 116.65 35.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.79 175.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.581 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -100.84 113.79 27.04 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 170.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.508 ' O ' ' HA ' ' A' 3659 ' ' ILE . 78.5 mt-30 -94.41 111.09 22.83 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.715 -178.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.582 HG12 HG12 ' A' 3659 ' ' ILE . 44.9 mt -92.24 98.62 8.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-O 121.024 0.44 . . . . 0.0 110.181 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -89.42 141.21 28.71 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.973 178.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.472 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 39.8 Cg_endo -67.05 172.93 9.14 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.583 2.188 . . . . 0.0 111.077 176.047 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -68.95 41.85 0.28 Allowed 'Trans proline' 0 CA--C 1.535 0.57 0 C-N-CA 122.739 2.293 . . . . 0.0 112.724 175.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.486 ' O ' ' HG2' ' A' 3636 ' ' GLU . 27.0 p -77.4 162.1 27.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.726 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -54.9 -35.23 63.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.303 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 28.6 t80 -53.9 -52.33 60.87 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.004 0.43 . . . . 0.0 110.601 176.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3635 ' ' SER . . . . . 0.45 ' HA ' ' HE3' ' A' 3658 ' ' MET . 7.1 m -62.46 -56.64 16.25 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.654 -178.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3636 ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.5 mm-40 -58.3 -43.05 87.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.869 -172.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 35.6 p -62.8 -47.91 81.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.055 0.455 . . . . 0.0 110.754 -178.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 69.4 m80 -66.9 -34.76 78.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.436 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3639 ' ' LEU . . . . . 0.432 HD23 HG13 ' A' 3527 ' ' VAL . 82.1 mt -63.48 -32.85 74.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.841 175.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.669 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 19.3 m -69.44 -33.8 73.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.198 0.523 . . . . 0.0 110.399 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -84.13 -34.52 24.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.337 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.57 HD12 HD22 ' A' 3575 ' ' LEU . 19.3 mt -93.73 -24.56 17.78 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -172.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -154.54 75.0 5.83 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.628 0.251 . . . . 0.0 111.388 178.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.77 -24.9 61.24 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.599 2.199 . . . . 0.0 113.417 -175.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 10.0 t70 -75.78 -55.15 5.91 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.566 ' HB3' ' CE1' ' A' 3505 ' ' TYR . 0.1 OUTLIER -68.13 -30.57 69.75 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 179.858 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.669 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -53.96 -47.63 71.12 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.217 176.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -65.55 -19.07 65.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.874 0.368 . . . . 0.0 111.189 -178.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 70.8 m -87.74 -35.35 17.96 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.872 176.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.518 ' HA ' ' CG2' ' A' 3653 ' ' ILE . 4.1 pt -79.94 -15.21 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.063 -178.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 49.0 m -61.92 -20.36 63.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.085 0.469 . . . . 0.0 110.181 175.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -88.31 -38.12 15.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.27 173.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.518 ' CG2' ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -104.42 44.07 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 122.508 1.147 . . . . 0.0 108.853 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.468 ' N ' ' HD2' ' A' 3655 ' ' PRO . 16.1 m -32.62 -47.69 0.51 Allowed Pre-proline 0 N--CA 1.468 0.435 0 CA-C-N 113.624 -1.625 . . . . 0.0 113.174 171.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.486 ' HG2' HD13 ' A' 3653 ' ' ILE . 14.7 Cg_endo -59.08 88.71 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.605 1.537 . . . . 0.0 111.9 170.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -154.66 169.64 23.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.369 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.577 HD13 HD11 ' A' 3595 ' ' LEU . 56.9 mt -121.88 133.71 54.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.371 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3658 ' ' MET . . . . . 0.45 ' HE3' ' HA ' ' A' 3635 ' ' SER . 15.7 tmm? -100.38 111.65 23.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.582 HG12 HG12 ' A' 3628 ' ' ILE . 75.9 mt -106.36 120.27 57.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.59 -170.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.674 HG11 ' HD2' ' A' 3573 ' ' TYR . 87.9 t -103.76 114.83 44.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.884 -178.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.607 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 69.7 mt -91.15 120.17 39.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.059 177.659 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -116.62 126.27 53.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.658 0.266 . . . . 0.0 110.763 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 23.4 p -96.91 122.85 40.34 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.282 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 33.8 t . . . . . 0 C--O 1.251 1.181 0 O-C-N 123.561 0.538 . . . . 0.0 110.983 178.531 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.585 ' CD2' ' HB2' ' A' 3553 ' ' MET . 7.2 m-85 . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 111.454 0.168 . . . . 0.0 111.454 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.844 ' HG2' ' H ' ' B' 2520 ' ' THR . 54.6 tt0 56.97 -150.11 0.45 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B 2520 ' ' THR . . . . . 0.844 ' H ' ' HG2' ' B' 2519 ' ' GLU . 5.9 t -167.32 132.34 1.99 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 175.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.731 HD11 HH11 ' A' 3552 ' ' ARG . 1.4 tp . . . . . 0 N--CA 1.449 -0.509 0 C-N-CA 120.415 -0.514 . . . . 0.0 110.019 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.533 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 113.33 0.863 . . . . 0.0 113.33 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.753 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -69.22 -15.31 63.35 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.501 -173.798 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.597 ' N ' HD11 ' A' 3502 ' ' LEU . 52.2 tptt -68.71 -24.0 64.43 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.541 176.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -100.32 -43.03 6.4 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.037 174.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.696 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -149.16 104.07 3.34 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.637 -179.104 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3506 ' ' PRO . . . . . 0.753 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 84.5 Cg_endo -84.51 173.97 8.16 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 123.988 3.125 . . . . 0.0 113.938 -174.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3507 ' ' ILE . . . . . . . . . . . . . 86.4 mt -71.83 133.42 31.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.915 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 26.9 m -100.94 -30.59 3.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.51 -178.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.595 ' CB ' HD12 ' A' 3538 ' ' LEU . 34.1 t-105 -150.23 149.72 30.57 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -143.77 119.35 10.4 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -174.48 -127.46 1.01 Allowed Glycine 0 N--CA 1.443 -0.853 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 -177.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.591 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -138.96 158.5 44.09 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.176 0.512 . . . . 0.0 111.124 177.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.466 HD22 ' HB2' ' A' 3547 ' ' LEU . 89.7 mt -108.93 148.88 30.01 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 168.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.703 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -142.85 129.33 20.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.848 0.356 . . . . 0.0 111.182 -179.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.753 HD11 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.32 138.15 39.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 171.655 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.753 ' CD ' HD11 ' A' 3515 ' ' LEU . 0.1 OUTLIER 63.94 -93.96 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -168.693 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 6.0 m120 -144.28 10.25 1.47 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.353 173.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.463 ' O ' ' HA ' ' A' 3514 ' ' ALA . 8.8 m-20 -86.72 132.98 33.71 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.218 -177.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 24.7 p -122.5 129.86 52.43 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.324 0.583 . . . . 0.0 111.945 -175.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -130.71 115.03 16.12 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.075 173.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.591 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.74 125.11 25.93 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.462 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 35.0 m -130.91 149.53 33.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.585 0.707 . . . . 0.0 111.972 -174.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -113.0 124.09 51.84 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.304 170.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.663 HD23 HD13 ' A' 3576 ' ' LEU . 0.8 OUTLIER -94.01 111.21 22.9 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.636 -174.319 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.412 ' CE1' HD11 ' A' 3579 ' ' LEU . 74.4 m80 -88.72 136.34 33.05 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.981 -1.008 . . . . 0.0 108.928 177.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.696 ' O ' ' HB2' ' A' 3505 ' ' TYR . 61.0 t80 -67.6 138.31 56.33 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.616 ' CG1' HD22 ' A' 3575 ' ' LEU . 21.9 t -114.59 -56.67 4.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.243 0.544 . . . . 0.0 110.812 176.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.443 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 61.4 m -160.52 171.4 19.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.91 -171.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.19 -152.77 23.01 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.8 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.558 ' HB2' ' HA ' ' A' 3571 ' ' THR . 48.1 t-20 -91.97 111.3 22.78 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -177.668 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -64.26 -33.21 75.3 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.929 0.395 . . . . 0.0 110.788 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 60.6 t -62.52 -30.34 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.294 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.506 HD22 ' HD3' ' A' 3536 ' ' ARG . 15.8 mt -59.47 -41.42 89.72 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.354 178.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -68.96 -41.35 78.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.986 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 80.7 t60 -63.69 -33.64 76.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.111 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3536 ' ' ARG . . . . . 0.506 ' HD3' HD22 ' A' 3533 ' ' LEU . 14.4 ptm180 -89.92 -11.73 40.94 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.469 ' O ' HG13 ' A' 3614 ' ' VAL . 47.5 p -103.7 -38.28 7.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.728 0.299 . . . . 0.0 111.522 -179.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.595 HD12 ' CB ' ' A' 3509 ' ' TRP . 20.3 mt -81.42 110.11 17.34 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.955 0.407 . . . . 0.0 110.005 -176.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3539 ' ' PRO . . . . . 0.413 ' HD3' ' O ' ' A' 3537 ' ' SER . 58.6 Cg_endo . . . . . 0 N--CA 1.46 -0.466 0 C-N-CA 122.936 2.424 . . . . 0.0 113.03 -175.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo . . . . . 0 C--O 1.236 0.408 0 CA-C-O 120.915 0.298 . . . . 0.0 112.68 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.608 ' HB3' HD12 ' A' 3612 ' ' ILE . 22.5 mt -67.7 113.91 5.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.63 179.12 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.703 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -96.62 138.16 34.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.133 0.492 . . . . 0.0 112.028 -172.061 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3549 ' ' ILE . . . . . . . . . . . . . 19.4 mt -95.98 107.57 19.89 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-O 122.236 1.017 . . . . 0.0 111.694 -172.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -113.93 -2.61 13.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.054 -173.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.655 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 69.4 mt-30 -146.81 176.72 9.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.359 0.123 . . . . 0.0 110.872 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.792 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.45 140.58 12.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.952 0.406 . . . . 0.0 111.604 179.285 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.577 ' HB2' ' CD2' ' B' 2518 ' ' TYR . 14.8 tmm? -109.71 122.8 48.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.174 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -69.88 110.07 4.8 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 -177.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.508 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -73.52 98.3 2.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.281 1.039 . . . . 0.0 109.524 -177.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' 3560 ' ' LEU . 34.2 mt-10 -111.49 171.67 7.34 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.67 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.4 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -57.54 -51.34 69.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.843 0.354 . . . . 0.0 111.041 -179.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 36.1 p -65.91 -32.81 74.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.387 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.573 ' O ' HG22 ' A' 3563 ' ' VAL . 18.9 mm-40 -71.53 -40.54 70.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.093 179.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' 3556 ' ' GLU . 84.8 mt -60.06 -34.27 73.2 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.019 0.437 . . . . 0.0 110.109 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' 3557 ' ' ALA . 17.5 mm-40 -60.9 -49.74 76.24 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.119 173.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -65.02 -30.2 77.37 Favored Glycine 0 CA--C 1.52 0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.771 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.597 ' O ' ' HG3' ' A' 3567 ' ' MET . 59.8 t -66.71 -53.87 30.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 174.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.22 -31.06 68.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.594 178.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -53.08 -51.82 60.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.691 176.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3566 ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' 3566 ' ' ARG . 14.0 ptt-85 -83.04 -9.28 59.33 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.093 0.473 . . . . 0.0 111.046 -178.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.597 ' HG3' ' O ' ' A' 3563 ' ' VAL . 81.2 mtp -84.5 -22.72 30.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.812 178.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 43.5 p -77.42 -5.73 50.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.035 0.445 . . . . 0.0 110.988 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 20.5 t -119.34 78.7 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.798 175.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.0 108.85 1.93 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.66 176.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.558 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 1.8 m 153.05 -41.73 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 O-C-N 124.921 1.388 . . . . 0.0 108.346 -176.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -84.96 -26.23 27.3 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.641 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.674 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -124.93 164.81 19.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.757 177.834 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.627 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 33.7 t -127.49 136.61 52.0 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 172.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.616 HD22 ' CG1' ' A' 3527 ' ' VAL . 13.0 tp -105.73 125.12 50.61 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.663 HD13 HD23 ' A' 3524 ' ' LEU . 67.7 mt -126.85 155.24 43.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.115 0.483 . . . . 0.0 111.035 -177.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.692 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.3 OUTLIER -123.79 107.19 11.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.203 179.257 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.456 ' HB2' HD11 ' A' 3659 ' ' ILE . . . -94.35 122.61 37.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.527 0.679 . . . . 0.0 110.488 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.459 HD23 HG22 ' A' 3650 ' ' ILE . 68.8 mt -122.88 147.58 51.53 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.658 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3580 ' ' PRO . . . . . 0.425 ' HA ' ' O ' ' A' 3521 ' ' ALA . 13.8 Cg_endo -57.42 125.47 18.93 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 122.096 1.864 . . . . 0.0 111.829 176.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 29.8 p -107.61 119.19 38.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.308 0.575 . . . . 0.0 110.164 178.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.49 146.08 16.13 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.769 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3583 ' ' ARG . . . . . 0.424 ' HG3' ' OD2' ' A' 3587 ' ' ASP . 35.6 mtp180 -69.97 -20.53 63.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.7 0.762 . . . . 0.0 108.946 173.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.589 ' O ' HG23 ' A' 3588 ' ' VAL . 9.7 t70 -154.26 169.55 23.39 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.553 -1.203 . . . . 0.0 107.876 -178.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -56.69 -44.69 81.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 118.165 0.439 . . . . 0.0 110.905 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.72 -35.51 80.8 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.484 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.424 ' OD2' ' HG3' ' A' 3583 ' ' ARG . 20.3 t70 -68.02 -40.72 82.9 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.194 -178.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' 3584 ' ' ASP . 73.9 t -56.12 -45.15 80.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.511 177.023 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 85.6 t -55.78 -46.96 80.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.786 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 28.7 t -65.28 -43.79 90.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.026 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -64.24 -37.28 86.91 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.49 179.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 90.1 m -60.95 -54.96 38.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.612 177.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -65.54 -36.0 82.52 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.276 -177.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 20.9 t -65.32 -44.42 87.86 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.575 HD13 HD11 ' A' 3657 ' ' LEU . 58.7 tp -64.66 -45.96 84.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.119 -178.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.789 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.62 -29.3 69.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.324 -176.42 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -85.6 -41.05 15.59 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.245 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -86.87 -46.36 9.99 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -171.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.478 ' HB2' HD12 ' A' 3595 ' ' LEU . 11.2 m-85 -98.91 -50.74 4.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.806 0.336 . . . . 0.0 111.212 -175.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.789 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 24.8 mm -59.8 -54.55 33.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.978 -176.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3601 ' ' THR . . . . . 0.455 ' O ' ' HG3' ' A' 3604 ' ' GLN . 59.2 m -62.42 -38.4 89.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.431 -178.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 43.0 t80 -72.05 -54.32 10.2 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.116 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.48 HD11 ' O ' ' A' 3608 ' ' ALA . 0.4 OUTLIER -57.01 -38.78 73.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.794 179.85 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3604 ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' 3601 ' ' THR . 0.0 OUTLIER -72.29 -34.64 68.32 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.149 -179.819 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -64.86 -36.98 86.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.874 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -84.1 -18.14 37.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.119 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 51.21 55.38 9.58 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -169.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.5 ' HB1' ' HB2' ' A' 3552 ' ' ARG . . . -135.21 -177.63 4.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.256 0.551 . . . . 0.0 112.113 -173.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.792 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.65 117.46 28.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.672 175.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -62.81 104.48 0.8 Allowed Glycine 0 C--O 1.224 -0.517 0 C-N-CA 120.751 -0.738 . . . . 0.0 111.365 178.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.655 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.5 mm -89.86 124.01 42.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.322 0.582 . . . . 0.0 110.884 -174.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.608 HD12 ' HB3' ' A' 3547 ' ' LEU . 45.7 mt -119.78 108.66 24.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.607 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.401 ' HA ' ' O ' ' A' 3624 ' ' TYR . 87.2 m-20 -85.22 121.17 27.58 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.67 -176.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3614 ' ' VAL . . . . . 0.469 HG13 ' O ' ' A' 3537 ' ' SER . 48.4 t . . . . . 0 C--N 1.322 -0.591 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.983 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.436 ' HB2' ' HB ' ' A' 3614 ' ' VAL . 60.0 m-85 . . . . . 0 CA--C 1.512 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.487 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.466 HG13 HD13 ' A' 3611 ' ' ILE . 4.1 t -126.05 113.89 36.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.095 177.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.611 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.4 mp -98.84 112.46 24.55 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.459 ' O ' ' HA ' ' A' 3659 ' ' ILE . 33.9 mt-30 -95.14 111.15 23.01 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.9 -176.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.57 HG12 HG12 ' A' 3659 ' ' ILE . 39.9 mt -93.12 99.12 9.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.628 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3629 ' ' PHE . . . . . 0.516 ' HB2' ' HE3' ' A' 3658 ' ' MET . 97.3 m-85 -89.71 145.21 33.04 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.005 178.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.32 169.37 18.5 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.427 2.085 . . . . 0.0 111.243 173.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.08 48.23 0.85 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.185 2.59 . . . . 0.0 112.576 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.9 p -74.72 163.4 27.73 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.374 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -47.43 -47.56 26.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.71 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 30.1 t80 -47.06 -48.11 22.52 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.414 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3635 ' ' SER . . . . . 0.494 ' HA ' ' HE1' ' A' 3658 ' ' MET . 20.6 t -59.26 -58.8 7.06 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.978 -178.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -66.76 -35.22 79.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.336 -171.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 62.0 m -58.18 -57.77 11.39 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 120.867 0.365 . . . . 0.0 110.725 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3638 ' ' HIS . . . . . 0.457 ' HE2' ' CE ' ' A' 3658 ' ' MET . 10.2 p80 -69.42 -26.14 64.47 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 120.145 -0.622 . . . . 0.0 110.721 -177.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 50.2 mt -64.42 -35.27 80.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.843 0.354 . . . . 0.0 110.375 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.923 ' HA ' HD23 ' A' 3647 ' ' LEU . 16.6 m -67.78 -39.01 84.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.232 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -78.18 -24.06 47.34 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.491 -177.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.587 HD12 HD23 ' A' 3575 ' ' LEU . 17.4 mt -101.13 -41.0 6.91 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -172.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.553 ' HB3' ' CZ ' ' A' 3505 ' ' TYR . . . -147.09 89.11 5.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.751 0.31 . . . . 0.0 111.687 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -78.14 -16.78 13.82 Favored 'Trans proline' 0 CA--C 1.534 0.475 0 C-N-CA 122.608 2.205 . . . . 0.0 113.974 -175.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 6.8 t0 -76.08 -53.4 8.39 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -177.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.692 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -73.13 -28.02 62.01 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 179.82 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.923 HD23 ' HA ' ' A' 3640 ' ' SER . 24.3 tp -52.15 -52.88 49.08 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.061 0.458 . . . . 0.0 111.04 175.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.23 -17.95 63.01 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.254 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 11.0 m -87.39 -37.34 17.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.474 178.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.549 ' HA ' ' CG2' ' A' 3653 ' ' ILE . 3.5 pt -79.4 -12.13 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.863 0.363 . . . . 0.0 111.392 -178.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 19.7 m -55.05 -37.97 67.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.485 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 8.8 t30 -80.16 -33.5 38.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.841 0.353 . . . . 0.0 110.743 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.549 ' CG2' ' HA ' ' A' 3650 ' ' ILE . 8.6 tp -104.01 39.67 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 122.585 1.184 . . . . 0.0 109.279 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.437 ' N ' ' HD2' ' A' 3655 ' ' PRO . 47.0 t -33.92 -46.03 0.63 Allowed Pre-proline 0 CA--C 1.541 0.604 0 CA-C-N 113.582 -1.644 . . . . 0.0 113.286 169.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.44 ' HG2' HD13 ' A' 3653 ' ' ILE . 19.8 Cg_endo -61.17 79.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.519 1.479 . . . . 0.0 111.776 170.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 31.5 p80 -143.78 170.31 16.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.999 -178.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.575 HD11 HD13 ' A' 3595 ' ' LEU . 69.2 mt -115.38 143.38 45.37 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.526 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3658 ' ' MET . . . . . 0.516 ' HE3' ' HB2' ' A' 3629 ' ' PHE . 8.7 tmm? -110.48 111.26 22.39 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 177.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.57 HG12 HG12 ' A' 3628 ' ' ILE . 70.3 mt -107.95 122.52 62.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.652 -170.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.674 HG13 ' HD2' ' A' 3573 ' ' TYR . 72.3 t -106.27 116.47 50.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.005 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.627 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 54.0 mt -91.0 113.12 26.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.213 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.81 128.92 56.26 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.107 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 13.7 m -76.14 132.12 39.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.955 174.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.441 -0.79 . . . . 0.0 109.696 175.677 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.577 ' CD2' ' HB2' ' A' 3553 ' ' MET . 13.2 m-85 . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 120.36 0.124 . . . . 0.0 111.238 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.643 ' HG2' ' H ' ' B' 2520 ' ' THR . 14.5 tt0 55.09 -157.28 0.22 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B 2520 ' ' THR . . . . . 0.643 ' H ' ' HG2' ' B' 2519 ' ' GLU . 85.3 m -155.53 121.26 5.01 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 174.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.565 HD11 ' HD2' ' A' 3552 ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.411 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.713 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.543 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp . . . . . 0 N--CA 1.455 -0.201 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.608 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.17 -15.68 62.98 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.239 -173.852 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.608 ' N ' HD13 ' A' 3502 ' ' LEU . 49.6 tptt -67.05 -30.58 70.69 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 177.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 17.1 tptm -96.37 -39.68 9.49 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.399 178.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.682 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -151.4 106.97 2.94 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 121.454 0.645 . . . . 0.0 111.148 178.756 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 3506 ' ' PRO . . . . . 0.595 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 97.5 Cg_endo -86.35 174.41 6.05 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 124.184 3.256 . . . . 0.0 113.937 -177.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.503 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 94.4 mt -71.4 135.41 28.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.259 -178.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3508 ' ' VAL . . . . . 0.487 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.4 m -102.46 -29.9 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.325 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.573 ' CB ' HD12 ' A' 3538 ' ' LEU . 39.9 t-105 -150.07 154.66 38.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.286 -178.32 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -150.52 119.14 6.51 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.3 -125.06 0.78 Allowed Glycine 0 N--CA 1.443 -0.881 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 -176.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.63 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.5 mp -141.44 158.57 43.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.087 0.47 . . . . 0.0 111.178 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.462 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 81.8 mt -113.24 150.25 32.64 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 169.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.574 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.21 125.62 13.97 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -177.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.581 HD11 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.39 138.71 38.5 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 171.944 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.581 ' HD3' HD11 ' A' 3515 ' ' LEU . 0.3 OUTLIER 59.97 -96.31 0.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.537 0.523 . . . . 0.0 110.122 -170.644 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -138.06 9.33 2.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.579 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -100.28 125.71 46.51 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.857 -177.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.445 HG21 ' HB1' ' A' 3514 ' ' ALA . 38.6 p -117.73 134.83 54.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.563 177.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -129.86 122.51 28.81 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.63 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.67 119.42 17.87 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.076 0.465 . . . . 0.0 110.133 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' 3579 ' ' LEU . 35.0 m -130.44 147.98 33.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.596 0.712 . . . . 0.0 112.061 -175.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -108.89 126.02 52.62 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.043 172.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.581 HD23 HD12 ' A' 3576 ' ' LEU . 1.2 mt -94.83 110.31 22.19 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.736 -176.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.503 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 79.2 m-70 -86.71 138.96 31.21 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.03 -0.986 . . . . 0.0 108.878 176.166 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.682 ' O ' ' HB2' ' A' 3505 ' ' TYR . 69.1 t80 -68.99 137.91 54.1 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 173.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.624 ' CG1' HD21 ' A' 3575 ' ' LEU . 23.3 t -114.61 -56.51 4.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 CA-C-O 121.474 0.654 . . . . 0.0 110.664 176.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.431 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 73.8 m -160.83 171.84 18.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.997 -172.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 90.12 -150.95 21.25 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.897 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.546 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.7 t-20 -101.53 111.73 24.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.955 0.407 . . . . 0.0 111.099 -177.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.2 p30 -62.31 -30.67 71.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.482 -177.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3532 ' ' VAL . . . . . 0.562 ' O ' ' HG2' ' A' 3536 ' ' ARG . 62.1 t -61.08 -35.57 66.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.491 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.407 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 29.7 mt -55.98 -40.45 73.31 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.929 177.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.403 ' HB2' ' CD1' ' A' 3538 ' ' LEU . . . -70.19 -37.14 75.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.994 0.426 . . . . 0.0 110.693 -179.504 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -61.5 -39.34 90.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.892 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3536 ' ' ARG . . . . . 0.562 ' HG2' ' O ' ' A' 3532 ' ' VAL . 12.5 ptp180 -88.7 -21.39 23.91 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -177.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.517 ' HB2' HD13 ' A' 3626 ' ' LEU . 58.0 p -90.17 -43.31 10.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.71 0.291 . . . . 0.0 111.508 -178.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.573 HD12 ' CB ' ' A' 3509 ' ' TRP . 25.2 mt -78.65 113.59 36.14 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -174.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo . . . . . 0 N--CA 1.461 -0.392 0 C-N-CA 123.174 2.583 . . . . 0.0 113.258 -170.803 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 3546 ' ' PRO . . . . . 0.609 ' HA ' ' O ' ' A' 3512 ' ' LEU . 93.2 Cg_endo . . . . . 0 N--CA 1.451 -0.974 0 CA-C-O 120.926 0.302 . . . . 0.0 112.232 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.559 ' HB3' HD11 ' A' 3612 ' ' ILE . 28.6 mt -69.24 113.22 6.39 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.795 175.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.574 ' HA ' ' O ' ' A' 3514 ' ' ALA . 40.4 ptt85 -91.41 135.76 33.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.936 0.398 . . . . 0.0 110.842 -175.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.548 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.2 mt -91.61 107.87 19.31 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-O 122.211 1.005 . . . . 0.0 111.021 -177.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.43 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -115.21 2.32 14.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.179 -0.918 . . . . 0.0 111.562 -175.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.691 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 73.9 mt-30 -151.54 171.94 16.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.581 0.229 . . . . 0.0 110.98 178.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.691 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.28 138.34 16.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.013 0.435 . . . . 0.0 111.322 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.54 ' HB3' ' HB1' ' A' 3609 ' ' ALA . 17.9 ttt -109.49 124.88 51.81 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.467 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -65.75 110.79 2.94 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.37 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.562 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -75.13 97.95 3.58 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 122.32 1.057 . . . . 0.0 108.965 178.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.633 ' HB2' ' HG2' ' A' 3559 ' ' GLN . 58.2 mm-40 -113.18 165.43 12.41 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.821 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.31 -51.87 65.31 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.319 0.387 . . . . 0.0 111.098 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 41.5 p -62.09 -33.15 73.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.073 0.463 . . . . 0.0 110.908 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.633 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 32.1 mm-40 -73.88 -44.43 55.35 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.047 -176.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.523 HD22 ' HB2' ' A' 3555 ' ' LEU . 83.0 mt -64.11 -32.56 74.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.254 -176.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' 3557 ' ' ALA . 8.0 mm-40 -69.23 -44.02 72.84 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3562 ' ' GLY . . . . . 0.404 ' O ' ' HB3' ' A' 3565 ' ' ARG . . . -59.49 -40.03 95.7 Favored Glycine 0 CA--C 1.52 0.357 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.312 176.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' 3559 ' ' GLN . 62.7 t -62.51 -48.02 90.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 175.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3564 ' ' ALA . . . . . 0.518 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.44 -32.3 70.08 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.113 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.498 ' O ' HG22 ' A' 3568 ' ' THR . 43.4 ttm180 -57.82 -46.26 84.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.81 177.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -87.05 -5.32 59.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.936 0.398 . . . . 0.0 111.297 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.518 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 82.5 mtp -88.65 -21.12 24.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.959 176.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3568 ' ' THR . . . . . 0.498 HG22 ' O ' ' A' 3565 ' ' ARG . 3.3 t -74.59 -14.34 60.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.84 0.352 . . . . 0.0 111.186 -174.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 99.2 t -114.4 101.98 13.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.113 0.482 . . . . 0.0 110.412 178.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -73.99 108.32 6.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.546 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.5 m 151.47 -39.96 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.45 1.5 . . . . 0.0 108.082 -174.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -82.46 -26.37 32.71 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.523 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.72 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.2 OUTLIER -135.36 169.06 18.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.294 179.061 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.574 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 34.5 t -130.1 136.56 49.46 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 171.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.624 HD21 ' CG1' ' A' 3527 ' ' VAL . 13.1 tp -106.54 125.98 51.69 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.581 HD12 HD23 ' A' 3524 ' ' LEU . 79.5 mt -127.53 157.05 41.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.175 0.512 . . . . 0.0 111.022 -177.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.622 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.4 OUTLIER -124.03 109.43 13.51 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.173 179.079 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.456 ' HB1' HD13 ' A' 3659 ' ' ILE . . . -95.1 123.36 38.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.277 0.561 . . . . 0.0 110.584 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.448 ' HG ' HD11 ' A' 3577 ' ' LEU . 69.0 mt -124.02 144.83 46.25 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.09 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.83 112.51 1.66 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.402 2.068 . . . . 0.0 111.955 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.9 p -96.74 108.31 20.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.222 0.534 . . . . 0.0 110.657 -177.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.06 146.79 16.67 Favored Glycine 0 N--CA 1.442 -0.93 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.059 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -68.31 -36.68 79.68 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.682 0.753 . . . . 0.0 109.46 179.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.604 ' O ' HG23 ' A' 3588 ' ' VAL . 17.1 t70 -129.72 164.71 23.4 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.311 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3585 ' ' GLN . . . . . 0.429 ' O ' HG23 ' A' 3589 ' ' VAL . 23.7 tp60 -56.61 -39.39 73.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.887 0.375 . . . . 0.0 110.374 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -64.58 -44.89 89.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.144 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.405 ' HB3' ' H ' ' A' 3584 ' ' ASP . 30.0 t70 -60.59 -43.16 97.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.308 178.553 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' 3584 ' ' ASP . 98.4 t -56.04 -47.99 79.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.215 177.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3589 ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' 3585 ' ' GLN . 80.4 t -60.06 -47.23 92.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.293 178.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 42.3 t -60.73 -42.06 96.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.061 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -69.55 -36.06 76.0 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.001 -0.279 . . . . 0.0 110.661 177.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 85.6 m -62.25 -53.17 58.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.697 178.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.57 -34.15 77.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.18 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.6 m -69.35 -46.12 67.77 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.884 0.374 . . . . 0.0 110.259 177.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.539 HD12 HD13 ' A' 3657 ' ' LEU . 63.9 tp -64.36 -43.55 94.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.958 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.799 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.1 OUTLIER -66.3 -32.87 74.54 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.958 -177.002 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.56 -37.58 22.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.795 0.331 . . . . 0.0 111.404 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3598 ' ' ALA . . . . . 0.559 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -88.95 -45.91 9.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -172.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.705 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 19.7 m-85 -99.73 -50.08 4.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.671 0.272 . . . . 0.0 111.542 -176.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.799 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 24.0 mm -62.04 -60.28 2.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.131 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 91.2 m -56.96 -42.44 80.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.147 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.705 ' HD2' ' HA ' ' A' 3599 ' ' PHE . 0.0 OUTLIER -63.52 -53.37 52.99 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.542 0.211 . . . . 0.0 110.826 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.699 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -66.73 -36.22 81.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.916 0.389 . . . . 0.0 110.916 -170.916 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -73.87 -36.35 64.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.075 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -71.46 -34.56 70.32 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.786 0.327 . . . . 0.0 110.911 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3606 ' ' LYS . . . . . 0.578 ' HG2' ' O ' ' A' 3602 ' ' TYR . 66.5 mmtt -73.92 -18.17 60.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 177.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3607 ' ' GLN . . . . . 0.501 ' O ' ' HG ' ' A' 3555 ' ' LEU . 21.1 mt-30 55.05 43.61 29.44 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -172.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3608 ' ' ALA . . . . . 0.522 ' HB3' ' HB2' ' A' 3552 ' ' ARG . . . -132.62 172.06 13.02 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.541 -170.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.691 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -107.95 118.67 37.35 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.354 172.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -63.01 103.6 0.67 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.211 177.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.691 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 32.7 mm -90.01 126.69 42.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 121.188 0.518 . . . . 0.0 110.924 -175.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.559 HD11 ' HB3' ' A' 3547 ' ' LEU . 39.7 mt -125.94 115.07 41.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.882 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3613 ' ' ASN . . . . . 0.425 ' HA ' ' O ' ' A' 3624 ' ' TYR . 6.9 m120 -90.09 119.75 30.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.0 179.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 30.2 m . . . . . 0 C--N 1.316 -0.859 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.863 -178.543 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A 3624 ' ' TYR . . . . . 0.491 ' OH ' ' HD3' ' A' 3536 ' ' ARG . 78.9 m-85 . . . . . 0 CA--C 1.511 -0.52 0 CA-C-O 121.031 0.443 . . . . 0.0 110.587 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.424 HG12 ' HG3' ' A' 3627 ' ' GLN . 5.7 t -119.37 114.7 45.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.99 178.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.606 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -96.27 110.93 23.15 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.469 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 18.3 mt-30 -94.44 110.43 22.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.826 -178.145 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.573 HG12 HG12 ' A' 3659 ' ' ILE . 35.6 mt -92.14 99.27 9.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.97 141.6 29.68 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.038 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.33 165.39 27.07 Favored 'Trans proline' 0 CA--C 1.53 0.309 0 C-N-CA 122.591 2.194 . . . . 0.0 111.233 175.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -69.28 77.93 0.87 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.535 2.157 . . . . 0.0 111.876 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.429 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.5 p -112.25 163.7 14.07 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.689 -174.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3633 ' ' GLU . . . . . 0.445 ' H ' ' CD ' ' A' 3633 ' ' GLU . 1.6 mp0 -46.47 -42.75 15.94 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.545 175.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 42.5 t80 -52.27 -52.12 54.55 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.451 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 55.1 p -69.69 -51.18 36.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.693 -177.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3636 ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' 3632 ' ' CYS . 13.3 mm-40 -60.35 -44.1 95.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.781 0.324 . . . . 0.0 111.361 -175.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 37.9 t -63.32 -39.51 94.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.192 0.52 . . . . 0.0 110.456 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 32.3 m80 -73.84 -33.07 63.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.66 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 75.8 mt -68.33 -37.22 80.34 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.407 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.459 ' CA ' ' HG ' ' A' 3647 ' ' LEU . 21.3 p -72.08 -31.1 65.78 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.255 0.55 . . . . 0.0 110.318 176.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3641 ' ' ARG . . . . . 0.482 ' HA ' ' CZ ' ' A' 3641 ' ' ARG . 1.2 tpm_? -76.04 -30.7 58.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.035 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.592 HD13 HD22 ' A' 3575 ' ' LEU . 16.4 mt -103.71 -32.65 9.27 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -172.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.421 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -148.7 72.74 10.59 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -175.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.57 -22.17 58.69 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 122.494 2.13 . . . . 0.0 111.764 179.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3645 ' ' ASP . . . . . 0.425 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 12.1 m-20 -70.1 -45.92 65.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.901 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.622 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -84.95 -30.74 24.04 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.575 176.73 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.459 ' HG ' ' CA ' ' A' 3640 ' ' SER . 3.4 tm? -54.19 -48.65 70.73 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.968 -179.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.66 -18.44 59.54 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.845 0.355 . . . . 0.0 111.67 -176.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 6.4 t -89.73 -38.28 13.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.189 179.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.515 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.1 pt -76.59 -13.32 14.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -175.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.7 m -63.22 -17.65 62.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.953 0.406 . . . . 0.0 110.756 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 8.3 t30 -88.33 -36.71 16.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.171 0.51 . . . . 0.0 109.888 173.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.515 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -104.85 41.93 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-O 122.41 1.1 . . . . 0.0 109.327 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.449 ' N ' ' HD2' ' A' 3655 ' ' PRO . 66.5 m -33.47 -45.7 0.53 Allowed Pre-proline 0 CA--C 1.539 0.536 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.83 170.127 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.498 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.2 Cg_endo -59.4 84.42 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.511 1.474 . . . . 0.0 111.562 169.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -150.74 170.93 18.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.434 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.539 HD13 HD12 ' A' 3595 ' ' LEU . 43.8 mt -123.17 136.32 54.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.559 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 14.5 tmm? -102.7 111.81 24.3 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.573 HG12 HG12 ' A' 3628 ' ' ILE . 70.8 mt -107.31 119.74 57.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.276 0.56 . . . . 0.0 111.529 -170.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.72 HG12 ' HD2' ' A' 3573 ' ' TYR . 81.0 t -102.93 116.5 46.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.77 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.606 HG12 ' HG ' ' A' 3626 ' ' LEU . 55.1 mt -91.05 112.46 25.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 176.016 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -115.16 133.67 55.83 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.433 -177.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.9 m -67.82 110.05 3.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.7 171.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.25 1.084 0 C-N-CA 124.679 1.192 . . . . 0.0 112.75 -174.364 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.48 ' CD1' ' HB2' ' A' 3553 ' ' MET . 40.9 m-85 . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 119.833 -0.127 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.567 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.5 OUTLIER 54.54 -163.11 0.12 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.589 0.709 . . . . 0.0 111.948 178.237 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 10.8 p -145.47 116.15 7.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.413 167.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.548 HD22 ' CG2' ' A' 3549 ' ' ILE . 3.1 tp . . . . . 0 CA--C 1.521 -0.167 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.254 -178.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3501 ' ' LEU . . . . . 0.479 HD11 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp . . . . . 0 CA--C 1.53 0.191 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3502 ' ' LEU . . . . . 0.592 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -68.94 -14.79 63.25 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.339 -174.567 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 3503 ' ' LYS . . . . . 0.577 ' N ' HD11 ' A' 3502 ' ' LEU . 12.2 tmtt? -66.6 -28.99 68.94 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 176.065 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -99.78 -42.88 6.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.356 177.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3505 ' ' TYR . . . . . 0.687 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.17 99.16 3.7 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 121.481 0.657 . . . . 0.0 110.781 -179.703 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 3506 ' ' PRO . . . . . 0.592 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 60.1 Cg_endo -80.29 173.65 12.25 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 123.817 3.011 . . . . 0.0 113.504 -178.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3507 ' ' ILE . . . . . 0.478 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 74.8 mt -71.31 135.73 27.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.112 -176.01 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 27.3 m -101.91 -29.14 3.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.408 -179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3509 ' ' TRP . . . . . 0.554 ' HB2' HD11 ' A' 3538 ' ' LEU . 74.7 t-105 -151.96 155.11 37.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.641 0.258 . . . . 0.0 110.717 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -148.13 118.93 7.56 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 176.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.86 -130.24 1.15 Allowed Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3512 ' ' LEU . . . . . 0.644 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -139.71 158.05 44.74 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.966 0.412 . . . . 0.0 110.803 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3513 ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' 3519 ' ' THR . 84.1 mt -110.47 149.65 30.0 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 170.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3514 ' ' ALA . . . . . 0.626 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.3 120.96 11.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -177.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3515 ' ' LEU . . . . . 0.634 HD11 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.27 145.75 41.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 172.935 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 3516 ' ' LYS . . . . . 0.634 ' HD3' HD11 ' A' 3515 ' ' LEU . 1.3 mptp? 63.64 -95.79 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -168.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -145.27 9.99 1.27 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.681 174.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3518 ' ' ASP . . . . . 0.402 ' O ' ' HA ' ' A' 3514 ' ' ALA . 27.3 m-20 -97.28 129.12 44.62 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.423 -174.344 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3519 ' ' THR . . . . . 0.511 HG23 ' HB3' ' A' 3514 ' ' ALA . 31.8 p -117.1 133.58 55.82 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.14 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -126.05 120.85 31.34 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3521 ' ' ALA . . . . . 0.644 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.17 120.64 18.06 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.086 0.47 . . . . 0.0 109.947 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3522 ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' 3579 ' ' LEU . 26.8 m -129.85 147.71 33.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.625 0.726 . . . . 0.0 111.822 -175.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -110.45 124.94 52.7 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.828 173.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3524 ' ' LEU . . . . . 0.602 HD23 HD13 ' A' 3576 ' ' LEU . 0.9 OUTLIER -94.17 109.96 21.72 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.597 -175.136 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 3525 ' ' HIS . . . . . 0.478 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 65.8 m80 -87.58 138.9 31.07 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.747 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3526 ' ' PHE . . . . . 0.687 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.2 t80 -67.56 136.41 54.47 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3527 ' ' VAL . . . . . 0.618 ' CG1' HD21 ' A' 3575 ' ' LEU . 26.1 t -114.68 -55.39 4.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 121.254 0.549 . . . . 0.0 110.765 176.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3528 ' ' SER . . . . . 0.496 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 72.9 m -162.01 172.53 15.8 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.948 -172.435 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3529 ' ' GLY . . . . . 0.416 ' HA2' ' HB3' ' A' 3570 ' ' GLU . . . 89.74 -152.21 22.29 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.338 -0.934 . . . . 0.0 112.166 178.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3530 ' ' ASN . . . . . 0.542 ' HB2' ' HA ' ' A' 3571 ' ' THR . 50.2 t30 -108.34 119.26 38.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.889 0.376 . . . . 0.0 110.463 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -63.41 -27.5 69.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.691 -177.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3532 ' ' VAL . . . . . 0.401 ' HB ' ' ND2' ' A' 3530 ' ' ASN . 62.4 t -57.86 -32.79 44.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.033 0.444 . . . . 0.0 110.649 178.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3533 ' ' LEU . . . . . 0.505 HD23 ' HD3' ' A' 3536 ' ' ARG . 28.3 mt -62.12 -40.61 96.5 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.367 178.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3534 ' ' ALA . . . . . 0.444 ' HA ' HD12 ' A' 3661 ' ' ILE . . . -65.5 -41.86 92.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.954 0.407 . . . . 0.0 110.195 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -61.03 -37.15 81.58 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.936 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3536 ' ' ARG . . . . . 0.505 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.6 ptm180 -89.78 -7.98 53.18 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3537 ' ' SER . . . . . 0.483 ' HB2' HD12 ' A' 3626 ' ' LEU . 41.1 p -105.14 -40.5 5.85 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.783 0.325 . . . . 0.0 111.621 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3538 ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' 3509 ' ' TRP . 28.2 mt -79.14 110.3 14.31 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-O 121.281 0.562 . . . . 0.0 109.708 -173.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo . . . . . 0 N--CA 1.459 -0.542 0 C-N-CA 123.123 2.548 . . . . 0.0 113.273 -170.821 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 3546 ' ' PRO . . . . . 0.562 ' HA ' ' O ' ' A' 3512 ' ' LEU . 87.4 Cg_endo . . . . . 0 N--CA 1.455 -0.756 0 CA-C-O 121.228 0.428 . . . . 0.0 112.733 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3547 ' ' LEU . . . . . 0.565 ' HB3' HD12 ' A' 3612 ' ' ILE . 30.3 mt -85.95 115.24 23.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.131 176.13 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3548 ' ' ARG . . . . . 0.626 ' HA ' ' O ' ' A' 3514 ' ' ALA . 37.7 ptt85 -91.35 140.76 29.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.19 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3549 ' ' ILE . . . . . 0.485 HD11 HD23 ' A' 3515 ' ' LEU . 17.3 mt -96.14 107.26 19.45 Favored 'Isoleucine or valine' 0 C--O 1.249 1.045 0 CA-C-O 122.5 1.143 . . . . 0.0 111.458 -177.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3550 ' ' ALA . . . . . 0.521 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -114.94 4.63 14.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.92 -172.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3551 ' ' GLN . . . . . 0.718 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 62.6 mt-30 -155.0 167.22 31.08 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.469 0.308 . . . . 0.0 110.804 177.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3552 ' ' ARG . . . . . 0.684 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -149.03 134.04 18.11 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.072 0.463 . . . . 0.0 111.228 177.508 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 3553 ' ' MET . . . . . 0.565 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 14.6 tmm? -108.76 116.34 31.79 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.329 178.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -65.25 110.24 2.51 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3555 ' ' LEU . . . . . 0.627 HD13 ' O ' ' A' 3555 ' ' LEU . 2.1 pp -69.67 98.71 1.21 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.053 0.93 . . . . 0.0 110.233 -175.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3556 ' ' GLU . . . . . 0.615 ' O ' ' HG ' ' A' 3560 ' ' LEU . 37.4 mt-10 -107.67 167.11 10.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.567 177.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3557 ' ' ALA . . . . . 0.497 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -57.71 -48.19 80.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.902 0.382 . . . . 0.0 110.238 178.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 1.7 p -62.29 -34.01 75.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.715 178.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3559 ' ' GLN . . . . . 0.538 ' O ' HG23 ' A' 3563 ' ' VAL . 86.8 mm-40 -74.38 -40.04 62.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.868 -179.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3560 ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' 3556 ' ' GLU . 74.9 mt -63.98 -34.18 77.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.4 179.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3561 ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.1 mm-40 -61.71 -45.6 93.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.13 0.49 . . . . 0.0 109.982 174.041 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -58.06 -44.96 94.43 Favored Glycine 0 N--CA 1.453 -0.186 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.214 175.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3563 ' ' VAL . . . . . 0.614 ' O ' ' HG3' ' A' 3567 ' ' MET . 40.2 t -61.83 -50.52 79.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.823 0.344 . . . . 0.0 110.28 177.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -58.45 -31.89 68.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.695 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3565 ' ' ARG . . . . . 0.482 ' O ' HG22 ' A' 3568 ' ' THR . 31.6 ttp85 -54.3 -46.21 72.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.745 178.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3566 ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' A' 3563 ' ' VAL . 16.9 ptt-85 -86.63 -12.74 47.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.872 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3567 ' ' MET . . . . . 0.614 ' HG3' ' O ' ' A' 3563 ' ' VAL . 86.3 mtp -78.25 -27.02 47.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 110.742 178.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3568 ' ' THR . . . . . 0.482 HG22 ' O ' ' A' 3565 ' ' ARG . 7.7 t -82.91 1.34 39.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.197 0.522 . . . . 0.0 110.276 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 51.7 t -128.42 87.41 1.08 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.689 176.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3570 ' ' GLU . . . . . 0.416 ' HB3' ' HA2' ' A' 3529 ' ' GLY . 49.3 mt-10 -70.4 109.21 4.63 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -179.1 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3571 ' ' THR . . . . . 0.542 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.4 m 151.17 -38.53 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.418 1.487 . . . . 0.0 108.438 -176.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -82.36 -29.98 30.62 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.263 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3573 ' ' TYR . . . . . 0.727 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -127.25 163.55 23.68 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.873 176.249 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 3574 ' ' CYS . . . . . 0.572 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 28.0 t -128.25 136.48 51.09 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 171.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3575 ' ' LEU . . . . . 0.618 HD21 ' CG1' ' A' 3527 ' ' VAL . 13.1 tp -106.06 125.61 51.2 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3576 ' ' LEU . . . . . 0.602 HD13 HD23 ' A' 3524 ' ' LEU . 79.7 mt -127.61 155.58 43.63 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.138 0.494 . . . . 0.0 110.825 -177.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3577 ' ' LEU . . . . . 0.704 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -123.03 107.9 12.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.387 179.776 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 3578 ' ' ALA . . . . . 0.439 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.27 123.53 37.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.325 0.584 . . . . 0.0 110.501 -177.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3579 ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' 3522 ' ' VAL . 53.6 mt -124.29 144.24 45.13 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 114.97 -1.013 . . . . 0.0 110.328 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.57 113.06 1.53 Allowed 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.37 2.047 . . . . 0.0 111.452 177.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.2 p -99.28 107.79 20.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.349 0.595 . . . . 0.0 110.362 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3582 ' ' GLY . . . . . 0.426 ' HA2' ' OD2' ' A' 3587 ' ' ASP . . . -98.28 145.6 17.83 Favored Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.563 179.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3583 ' ' ARG . . . . . 0.404 ' HG2' ' OD2' ' A' 3587 ' ' ASP . 27.2 mmt-85 -64.4 -43.04 95.67 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3584 ' ' ASP . . . . . 0.574 ' O ' HG23 ' A' 3588 ' ' VAL . 5.3 p-10 -134.65 -179.77 5.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.096 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -57.7 -43.6 85.28 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.102 0.251 . . . . 0.0 111.336 -175.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.33 -43.85 89.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.345 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3587 ' ' ASP . . . . . 0.426 ' OD2' ' HA2' ' A' 3582 ' ' GLY . 26.8 t70 -60.84 -44.67 96.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.398 -179.172 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3588 ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' 3584 ' ' ASP . 98.4 t -56.52 -39.82 64.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.71 178.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3589 ' ' VAL . . . . . 0.435 ' O ' ' HG2' ' A' 3593 ' ' GLU . 13.1 t -64.87 -51.1 71.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.582 0.706 . . . . 0.0 109.641 -179.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 34.3 m -64.32 -37.99 89.46 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.196 -177.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -71.42 -37.17 71.48 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.128 -0.358 . . . . 0.0 111.061 177.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 89.2 m -63.32 -50.07 71.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.644 0.259 . . . . 0.0 110.818 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3593 ' ' GLU . . . . . 0.512 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 8.8 pt-20 -64.2 -37.11 86.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.97 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 7.6 t -67.52 -43.12 81.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.822 0.344 . . . . 0.0 110.232 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3595 ' ' LEU . . . . . 0.557 HD11 HD11 ' A' 3657 ' ' LEU . 61.4 tp -63.42 -46.63 85.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.101 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3596 ' ' LYS . . . . . 0.819 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 57.5 pttt -67.84 -30.58 70.01 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.008 -177.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.78 -38.44 54.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.729 0.299 . . . . 0.0 111.57 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -93.91 -45.93 7.4 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -171.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3599 ' ' PHE . . . . . 0.502 ' CZ ' HD21 ' A' 3515 ' ' LEU . 12.0 m-85 -98.97 -50.07 4.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.651 0.262 . . . . 0.0 111.683 -175.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3600 ' ' ILE . . . . . 0.819 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.6 mm -61.88 -60.08 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.261 -175.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 74.8 m -53.29 -40.92 65.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.675 0.274 . . . . 0.0 111.089 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3602 ' ' TYR . . . . . 0.801 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -64.71 -57.07 9.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.082 179.503 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 3603 ' ' LEU . . . . . 0.801 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.1 OUTLIER -57.99 -41.62 83.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.644 0.259 . . . . 0.0 111.43 -177.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -72.66 -36.09 67.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.567 -176.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.74 68.44 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.942 0.401 . . . . 0.0 110.961 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -81.2 -19.1 44.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.78 177.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3607 ' ' GLN . . . . . 0.543 ' O ' ' HG ' ' A' 3555 ' ' LEU . 46.3 mt-30 50.39 52.06 15.57 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -171.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3608 ' ' ALA . . . . . . . . . . . . . . . -135.45 -176.19 4.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.193 -171.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3609 ' ' ALA . . . . . 0.684 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.4 117.97 29.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.537 176.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3610 ' ' GLY . . . . . 0.402 ' N ' HD12 ' A' 3603 ' ' LEU . . . -65.24 102.4 0.66 Allowed Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.244 -0.742 . . . . 0.0 111.244 177.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3611 ' ' ILE . . . . . 0.718 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 32.4 mm -89.3 126.18 42.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-O 121.201 0.525 . . . . 0.0 110.762 -175.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3612 ' ' ILE . . . . . 0.565 HD12 ' HB3' ' A' 3547 ' ' LEU . 34.1 mt -122.07 112.92 36.74 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.221 177.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 15.5 m120 -84.64 111.7 19.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.121 -179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 C--N 1.321 -0.641 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.662 179.604 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 3624 ' ' TYR . . . . . . . . . . . . . 80.7 m-85 . . . . . 0 N--CA 1.449 -0.49 0 CA-C-O 120.927 0.394 . . . . 0.0 109.962 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A 3625 ' ' VAL . . . . . 0.44 HG12 HG23 ' A' 3611 ' ' ILE . 3.1 t -118.97 115.57 48.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.067 179.262 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3626 ' ' LEU . . . . . 0.611 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -97.82 113.79 25.68 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 169.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3627 ' ' GLN . . . . . 0.561 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 95.0 mt-30 -94.48 111.42 23.17 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.225 -178.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3628 ' ' ILE . . . . . 0.58 HG12 HG12 ' A' 3659 ' ' ILE . 40.9 mt -92.08 98.22 8.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.034 178.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -88.96 141.94 29.94 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.855 178.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3630 ' ' PRO . . . . . 0.598 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.6 Cg_endo -70.83 169.24 20.75 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 122.487 2.125 . . . . 0.0 111.414 176.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -68.0 74.31 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.684 2.256 . . . . 0.0 111.833 176.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3632 ' ' CYS . . . . . 0.578 ' O ' ' HG2' ' A' 3636 ' ' GLU . 9.0 p -111.69 163.34 14.23 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.642 -174.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -47.69 -41.66 23.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.738 177.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 39.1 t80 -53.91 -52.42 60.59 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.441 177.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 56.4 p -70.29 -53.55 16.38 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.686 -177.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3636 ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.1 mm-40 -56.21 -44.76 79.82 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 123.445 0.466 . . . . 0.0 111.072 -174.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 48.4 t -61.97 -53.11 60.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.565 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 43.2 m80 -61.62 -34.86 76.4 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.573 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.55 -31.3 71.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.315 177.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3640 ' ' SER . . . . . 0.61 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 21.8 m -71.16 -29.91 65.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.33 0.586 . . . . 0.0 110.035 -178.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -89.05 -44.57 10.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.424 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3642 ' ' LEU . . . . . 0.576 HD13 HD23 ' A' 3575 ' ' LEU . 22.8 mt -78.48 -30.85 47.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.246 -0.434 . . . . 0.0 112.17 -173.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3643 ' ' ALA . . . . . 0.426 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -150.78 69.54 8.55 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.456 0.17 . . . . 0.0 111.369 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.0 -19.39 66.4 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.417 2.078 . . . . 0.0 111.731 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3645 ' ' ASP . . . . . 0.453 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 18.1 m-20 -72.83 -51.42 18.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.204 -177.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3646 ' ' LEU . . . . . 0.704 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -79.5 -29.94 41.77 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.183 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 3647 ' ' LEU . . . . . 0.61 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -54.26 -45.72 72.48 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.424 178.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.32 -31.13 69.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.96 0.409 . . . . 0.0 111.119 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 15.3 m -76.78 -36.56 56.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.852 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3650 ' ' ILE . . . . . 0.636 ' HA ' HG21 ' A' 3653 ' ' ILE . 7.0 pt -83.5 -9.89 11.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.925 0.393 . . . . 0.0 111.293 -176.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 8.3 t -60.18 -25.53 65.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.329 176.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 17.9 m120 -88.01 -32.56 18.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.033 0.444 . . . . 0.0 110.305 175.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3653 ' ' ILE . . . . . 0.636 HG21 ' HA ' ' A' 3650 ' ' ILE . 0.4 OUTLIER -104.68 36.1 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-O 122.847 1.308 . . . . 0.0 109.16 -177.121 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A 3654 ' ' SER . . . . . 0.43 ' N ' ' HD2' ' A' 3655 ' ' PRO . 49.5 m -30.31 -45.61 0.26 Allowed Pre-proline 0 N--CA 1.473 0.701 0 CA-C-N 113.966 -1.47 . . . . 0.0 114.433 172.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3655 ' ' PRO . . . . . 0.544 ' HG2' HD13 ' A' 3653 ' ' ILE . 11.9 Cg_endo -58.28 80.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 121.826 1.684 . . . . 0.0 111.842 169.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -146.91 169.39 19.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.762 -176.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3657 ' ' LEU . . . . . 0.557 HD11 HD11 ' A' 3595 ' ' LEU . 50.3 mt -121.64 137.15 54.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.656 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.3 tmm? -104.39 112.55 25.64 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3659 ' ' ILE . . . . . 0.58 HG12 HG12 ' A' 3628 ' ' ILE . 73.1 mt -106.62 121.27 59.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.237 0.542 . . . . 0.0 111.59 -171.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3660 ' ' VAL . . . . . 0.727 HG13 ' HD2' ' A' 3573 ' ' TYR . 79.5 t -104.47 116.43 48.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.914 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3661 ' ' ILE . . . . . 0.611 HG12 ' HG ' ' A' 3626 ' ' LEU . 73.4 mt -91.07 115.72 30.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 176.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -122.96 133.58 54.37 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.226 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.1 m -78.49 110.19 13.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 3.4 p . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.921 -1.038 . . . . 0.0 111.262 -175.449 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B 2518 ' ' TYR . . . . . 0.565 ' CD1' ' HB2' ' A' 3553 ' ' MET . 7.6 m-85 . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 119.17 -0.443 . . . . 0.0 112.144 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B 2519 ' ' GLU . . . . . 0.484 ' HG2' ' HE ' ' A' 3552 ' ' ARG . 30.6 tt0 44.49 95.94 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 172.092 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B 2520 ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' 3550 ' ' ALA . 17.5 p -57.64 131.12 49.29 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 122.291 -0.256 . . . . 0.0 111.189 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B 2521 ' ' LEU . . . . . 0.521 ' H ' ' C ' ' A' 3550 ' ' ALA . 16.7 tp . . . . . 0 C--O 1.234 0.238 0 C-N-CA 121.178 -0.209 . . . . 0.0 110.558 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.844 HG12 ' HB3' ' A' 3649 ' ' SER . 95.3 t . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 20.7 t70 -105.84 111.21 23.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.006 0.431 . . . . 0.0 110.126 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.484 ' O ' HD12 ' A' 3502 ' ' LEU . 67.7 mtm -81.57 -20.33 40.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.436 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.424 ' HA ' HD12 ' A' 3502 ' ' LEU . 21.5 t -65.8 -26.87 39.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.408 -172.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -77.16 -55.91 5.02 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.389 0.614 . . . . 0.0 110.279 172.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.592 HD11 ' HB2' ' A' 3646 ' ' LEU . 2.0 pp -72.03 -31.97 66.68 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.493 -168.012 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.609 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.25 -16.23 63.01 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.234 -174.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.609 ' N ' HD13 ' A' 3502 ' ' LEU . 73.6 mmtt -72.0 -25.05 61.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.312 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 85.3 mttt -104.41 -44.53 4.9 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.507 0.67 . . . . 0.0 110.511 177.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.743 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -142.47 94.33 6.81 Favored Pre-proline 0 N--CA 1.435 -1.191 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.192 -176.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -80.64 174.17 11.41 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 123.811 3.007 . . . . 0.0 113.432 -178.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.45 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.2 mt -70.57 136.81 25.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.792 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 28.6 m -108.02 -20.33 6.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.699 -177.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.745 ' HE3' HD13 ' A' 3524 ' ' LEU . 24.2 t90 -159.69 153.16 22.45 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.643 0.259 . . . . 0.0 110.388 -176.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -148.27 119.9 8.02 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 177.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -172.91 -129.65 1.17 Allowed Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.743 -0.741 . . . . 0.0 111.515 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.619 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -140.01 155.86 46.89 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.073 0.463 . . . . 0.0 111.196 -179.305 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.48 HD23 ' HB2' ' A' 3547 ' ' LEU . 83.2 mt -107.63 152.43 24.3 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 168.47 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.628 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -146.86 122.47 10.46 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.571 HD11 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.89 145.21 41.86 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 171.6 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.571 ' HD3' HD11 ' A' 3515 ' ' LEU . 0.1 OUTLIER 59.83 -96.16 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.989 0.423 . . . . 0.0 110.069 -168.352 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -143.68 8.49 1.52 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -102.35 122.42 44.22 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.14 -173.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 66.6 p -108.62 152.7 24.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.104 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -141.61 114.75 8.71 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.193 173.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.619 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -69.01 117.2 10.36 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 176.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.422 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.9 m -131.31 148.16 32.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.426 -177.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -112.57 132.88 54.91 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.042 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.745 HD13 ' HE3' ' A' 3509 ' ' TRP . 0.9 OUTLIER -100.64 113.11 25.67 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.408 0.623 . . . . 0.0 112.189 -173.087 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.45 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 83.0 m-70 -87.32 137.56 32.24 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.481 174.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.743 ' O ' ' HB2' ' A' 3505 ' ' TYR . 62.1 t80 -66.14 139.83 58.17 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 174.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.645 ' CG1' HD23 ' A' 3575 ' ' LEU . 16.2 t -116.62 -55.64 4.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.362 0.601 . . . . 0.0 111.304 175.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.412 ' HB3' ' HB3' ' A' 3575 ' ' LEU . 13.6 t -158.02 170.14 22.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.917 -169.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3529 ' ' GLY . . . . . 0.403 ' HA2' ' HB3' ' A' 3570 ' ' GLU . . . 87.03 -152.23 24.43 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.86 175.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.441 ' HB2' ' HA ' ' A' 3571 ' ' THR . 52.2 t-20 -97.95 114.58 26.73 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -64.21 -28.22 69.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.73 0.3 . . . . 0.0 111.356 -177.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 60.9 t -64.84 -31.12 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.827 0.346 . . . . 0.0 110.442 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.499 HD21 ' HD3' ' A' 3536 ' ' ARG . 18.5 mt -57.31 -39.0 74.91 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.91 176.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.441 ' HA ' HD11 ' A' 3661 ' ' ILE . . . -70.83 -44.62 66.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.852 0.358 . . . . 0.0 110.498 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 59.0 t60 -60.76 -32.51 71.81 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.023 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3536 ' ' ARG . . . . . 0.499 ' HD3' HD21 ' A' 3533 ' ' LEU . 14.1 ptm180 -89.07 -18.27 27.62 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -177.523 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.448 ' HB2' HG22 ' A' 3614 ' ' VAL . 42.3 p -98.66 -39.07 8.86 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 122.128 -0.357 . . . . 0.0 111.428 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.563 HD12 ' HB2' ' A' 3509 ' ' TRP . 30.6 mt -80.27 110.69 17.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.272 -174.066 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -80.67 160.6 21.89 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 123.351 2.701 . . . . 0.0 112.882 -172.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.675 ' HA ' ' HD2' ' A' 3545 ' ' PRO . 1.3 pt? -159.14 165.87 32.79 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.293 -179.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 49.8 m -162.15 -47.25 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.084 176.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3542 ' ' GLU . . . . . 0.414 ' H ' ' CD ' ' A' 3542 ' ' GLU . 0.0 OUTLIER -108.31 -30.34 8.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.867 -1.061 . . . . 0.0 109.149 176.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . -176.88 -32.71 0.05 OUTLIER Glycine 0 N--CA 1.442 -0.912 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.737 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3544 ' ' GLY . . . . . 0.406 ' HA2' ' HD2' ' A' 3545 ' ' PRO . . . 154.98 100.1 0.18 Allowed Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 121.233 -0.508 . . . . 0.0 111.992 178.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3545 ' ' PRO . . . . . 0.675 ' HD2' ' HA ' ' A' 3540 ' ' LEU . 18.6 Cg_endo -58.28 146.49 88.96 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.959 2.439 . . . . 0.0 112.052 178.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.572 ' HA ' ' O ' ' A' 3512 ' ' LEU . 15.9 Cg_endo -57.24 120.14 7.87 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.841 2.361 . . . . 0.0 112.799 -177.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.605 ' HB3' HD12 ' A' 3612 ' ' ILE . 29.4 mt -68.92 116.4 9.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.333 177.181 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.628 ' HA ' ' O ' ' A' 3514 ' ' ALA . 16.9 ptt180 -90.35 139.07 31.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.36 -175.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.438 HD12 HD22 ' A' 3515 ' ' LEU . 31.7 mt -93.1 105.86 17.28 Favored 'Isoleucine or valine' 0 C--O 1.242 0.688 0 CA-C-O 122.066 0.936 . . . . 0.0 110.555 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -103.84 -14.56 15.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.45 -171.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.656 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 96.1 mt-30 -146.78 177.65 8.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.697 -177.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.731 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -152.82 140.95 20.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 0.0 111.689 -178.94 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.54 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 17.2 ttt -111.41 110.48 20.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.727 176.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -61.67 110.7 1.58 Allowed 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.497 ' O ' HD12 ' A' 3555 ' ' LEU . 2.4 pp -75.2 98.82 3.84 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.007 0.908 . . . . 0.0 110.023 -176.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.699 ' O ' ' HG ' ' A' 3560 ' ' LEU . 33.6 mt-10 -101.54 162.59 12.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.122 174.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.488 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -59.9 -38.02 81.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.138 0.494 . . . . 0.0 109.805 177.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 3.1 p -66.98 -41.08 87.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.162 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.664 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 77.6 mm-40 -63.68 -42.93 97.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.068 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.699 ' HG ' ' O ' ' A' 3556 ' ' GLU . 78.2 mt -60.83 -32.93 72.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.315 -178.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.617 ' O ' ' HD3' ' A' 3565 ' ' ARG . 10.9 mm-40 -60.95 -50.78 71.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.211 0.529 . . . . 0.0 109.72 173.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.28 -41.48 99.52 Favored Glycine 0 N--CA 1.452 -0.248 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.067 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.528 HG23 ' O ' ' A' 3559 ' ' GLN . 69.3 t -60.47 -48.28 89.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 176.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.69 76.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.247 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.617 ' HD3' ' O ' ' A' 3561 ' ' GLU . 5.1 mpt_? -59.45 -41.73 90.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.236 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 24.7 ptt180 -88.2 -9.93 51.47 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.724 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.516 ' HG3' ' O ' ' A' 3563 ' ' VAL . 84.5 mtp -83.22 -29.41 28.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.939 0.4 . . . . 0.0 110.531 176.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3568 ' ' THR . . . . . 0.476 HG23 ' O ' ' A' 3565 ' ' ARG . 7.0 t -75.41 -15.1 60.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.065 0.46 . . . . 0.0 110.228 -178.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 46.0 t -103.12 87.0 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.958 177.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3570 ' ' GLU . . . . . 0.403 ' HB3' ' HA2' ' A' 3529 ' ' GLY . 45.3 mt-10 -74.4 107.64 6.68 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.441 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.1 m 155.68 -42.11 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 125.227 1.411 . . . . 0.0 107.662 -172.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.03 -30.91 31.23 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.48 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.84 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.1 OUTLIER -126.67 164.03 22.19 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.201 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.577 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 38.3 t -127.59 135.59 50.49 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 171.511 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.645 HD23 ' CG1' ' A' 3527 ' ' VAL . 12.8 tp -106.27 125.8 51.44 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.507 HD13 HD21 ' A' 3524 ' ' LEU . 79.4 mt -127.59 154.66 44.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.158 0.504 . . . . 0.0 110.693 -177.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.698 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.4 OUTLIER -119.75 109.76 15.99 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.135 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.473 ' HB3' HD12 ' A' 3659 ' ' ILE . . . -94.55 119.74 33.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.366 0.603 . . . . 0.0 110.391 -179.206 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.493 ' HG ' HD11 ' A' 3577 ' ' LEU . 59.0 mt -119.4 142.92 33.4 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 114.721 -1.127 . . . . 0.0 109.987 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.65 113.35 1.52 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.437 2.091 . . . . 0.0 111.612 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.5 p -96.38 106.01 18.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.483 0.659 . . . . 0.0 110.448 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -102.09 147.72 17.42 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.652 178.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 48.1 ttp180 -58.75 -43.47 90.3 Favored 'General case' 0 N--CA 1.428 -1.558 0 CA-C-O 121.371 0.605 . . . . 0.0 110.421 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.597 ' O ' HG21 ' A' 3588 ' ' VAL . 3.9 p30 -142.23 177.77 8.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.012 -0.995 . . . . 0.0 108.97 178.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3585 ' ' GLN . . . . . 0.414 ' O ' HG23 ' A' 3589 ' ' VAL . 64.4 tt0 -51.93 -46.36 64.64 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.512 0.508 . . . . 0.0 111.53 -176.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -62.57 -46.66 87.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.409 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 22.8 t70 -60.54 -41.43 94.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.06 0.457 . . . . 0.0 110.632 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.597 HG21 ' O ' ' A' 3584 ' ' ASP . 96.1 t -57.54 -45.27 86.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.574 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3589 ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' 3585 ' ' GLN . 83.0 t -57.76 -46.16 86.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.697 178.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 14.3 t -64.09 -42.88 96.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.724 -178.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3591 ' ' GLN . . . . . 0.554 ' NE2' ' H ' ' A' 3521 ' ' ALA . 13.4 mm100 -65.22 -39.94 93.44 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.628 178.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3592 ' ' THR . . . . . 0.431 ' O ' ' HG3' ' A' 3596 ' ' LYS . 31.6 m -61.85 -45.43 93.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.082 177.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -59.77 -50.09 75.18 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.921 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 61.3 m -61.08 -45.24 95.53 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.936 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.572 HD13 HD11 ' A' 3657 ' ' LEU . 44.8 tp -61.71 -45.33 94.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.072 -177.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.588 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 51.8 mtmt -57.95 -44.95 87.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.085 -179.615 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.88 -38.32 53.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.906 -175.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -89.69 -46.96 8.25 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -170.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.472 ' HB2' HD11 ' A' 3595 ' ' LEU . 22.9 m-85 -100.24 -50.84 3.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.721 0.296 . . . . 0.0 111.505 -175.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.588 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 32.4 mm -60.67 -58.91 5.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.841 -175.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 87.0 m -60.12 -42.57 95.06 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.363 -178.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 40.4 t80 -65.3 -53.59 41.72 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.044 -178.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.517 HD11 ' N ' ' A' 3610 ' ' GLY . 0.3 OUTLIER -61.74 -37.15 83.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.568 0.223 . . . . 0.0 111.457 -176.599 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -76.73 -30.71 56.72 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -66.78 -36.24 81.94 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.164 0.506 . . . . 0.0 110.427 176.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -82.1 -18.49 42.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.589 178.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 50.05 54.52 10.94 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -168.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.475 ' O ' HD12 ' A' 3603 ' ' LEU . . . -136.05 -177.79 4.85 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.857 -172.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.731 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -116.67 120.2 37.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.959 176.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3610 ' ' GLY . . . . . 0.517 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.19 103.64 0.76 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 176.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.656 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 34.1 mm -89.36 117.84 33.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.239 0.542 . . . . 0.0 110.647 -174.584 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.605 HD12 ' HB3' ' A' 3547 ' ' LEU . 17.5 mt -113.74 117.2 54.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.225 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.5 ' HA ' ' O ' ' A' 3624 ' ' TYR . 10.0 m120 -92.38 117.42 29.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.758 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.448 HG22 ' HB2' ' A' 3537 ' ' SER . 31.5 m -116.64 147.94 40.86 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.249 176.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.538 ' HA ' ' O ' ' A' 3621 ' ' GLN . 71.8 Cg_endo -91.03 143.25 3.23 Favored 'Trans proline' 0 N--CA 1.445 -1.382 0 C-N-CA 122.21 1.94 . . . . 0.0 111.602 171.171 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3616 ' ' ASN . . . . . . . . . . . . . 8.2 t30 -75.12 130.15 81.22 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 175.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -50.11 118.68 4.12 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 123.441 2.76 . . . . 0.0 112.585 -178.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 96.04 -30.31 8.74 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.288 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 7.4 m -89.5 -34.71 16.3 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.779 0.323 . . . . 0.0 110.286 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 94.0 m-20 63.26 16.45 9.45 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.337 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.538 ' O ' ' HA ' ' A' 3615 ' ' PRO . 15.8 mm-40 -99.03 117.23 64.57 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 176.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.426 ' C ' ' H ' ' A' 3624 ' ' TYR . 74.0 Cg_endo -74.69 25.67 0.36 Allowed 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 123.468 2.779 . . . . 0.0 113.04 -178.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3623 ' ' ALA . . . . . 0.403 ' H ' ' C ' ' A' 3621 ' ' GLN . . . -77.08 32.26 0.14 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.051 0.453 . . . . 0.0 111.786 -176.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.5 ' O ' ' HA ' ' A' 3613 ' ' ASN . 38.5 m-85 -120.08 133.09 55.62 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 177.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.465 HG12 HG22 ' A' 3611 ' ' ILE . 8.1 t -116.98 114.55 46.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.612 -177.288 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.615 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -97.86 112.72 24.53 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 169.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.511 ' HB2' ' HB ' ' A' 3660 ' ' VAL . 40.5 mt-30 -94.21 110.98 22.68 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.008 -176.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.586 HG12 HG12 ' A' 3659 ' ' ILE . 43.5 mt -91.99 98.33 8.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.341 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -89.23 137.51 29.26 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.767 177.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.31 171.14 9.65 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.755 2.304 . . . . 0.0 111.68 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.42 52.98 2.08 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.671 2.248 . . . . 0.0 112.438 177.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 17.8 p -85.42 162.24 19.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.53 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -48.66 -45.83 39.34 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.597 0.561 . . . . 0.0 111.111 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 16.7 t80 -48.94 -46.29 43.06 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.421 177.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 7.4 m -64.67 -53.97 39.05 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.833 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -64.42 -33.13 75.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.155 -175.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 38.4 m -63.38 -48.6 77.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.106 0.479 . . . . 0.0 110.455 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -68.46 -37.66 80.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.358 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 74.0 mt -62.43 -41.76 98.95 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.648 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 5.1 p -68.35 -30.87 69.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.022 0.439 . . . . 0.0 110.831 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -79.61 -38.62 33.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.122 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.598 HD12 HD22 ' A' 3575 ' ' LEU . 19.4 mt -86.39 -37.31 18.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.431 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -144.23 74.85 15.65 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -176.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.92 -21.33 57.32 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.517 2.144 . . . . 0.0 111.828 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3645 ' ' ASP . . . . . 0.576 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.6 m-20 -73.36 -44.66 58.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.488 -177.075 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.698 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -84.5 -31.21 24.61 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 177.742 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.648 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.2 tm? -53.78 -41.31 67.07 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.577 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -64.55 -18.14 64.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.875 -178.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.844 ' HB3' HG12 ' A' 3496 ' ' VAL . 72.4 m -90.38 -34.32 15.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.824 0.345 . . . . 0.0 111.024 176.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.553 ' HA ' HG21 ' A' 3653 ' ' ILE . 5.8 pt -83.8 -13.36 11.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.688 -174.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 33.7 p -58.34 -28.5 65.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.059 0.457 . . . . 0.0 110.867 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 10.1 m120 -88.75 -33.09 17.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.074 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.553 HG21 ' HA ' ' A' 3650 ' ' ILE . 9.4 tp -105.19 37.54 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 122.218 1.008 . . . . 0.0 109.398 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.492 ' N ' ' HD2' ' A' 3655 ' ' PRO . 7.9 m -35.72 -43.59 0.77 Allowed Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 114.15 -1.386 . . . . 0.0 113.916 173.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' 3654 ' ' SER . 15.0 Cg_endo -59.24 81.59 0.05 OUTLIER 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.925 1.75 . . . . 0.0 112.213 170.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3656 ' ' HIS . . . . . 0.457 ' CB ' HD22 ' A' 3579 ' ' LEU . 34.3 p80 -155.18 179.7 8.9 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.734 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.572 HD11 HD13 ' A' 3595 ' ' LEU . 23.6 mt -122.75 147.86 46.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.768 -177.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.6 ttp -108.22 110.08 21.62 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 174.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.586 HG12 HG12 ' A' 3628 ' ' ILE . 78.2 mt -103.59 120.49 53.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.149 0.499 . . . . 0.0 111.597 -172.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.84 HG12 ' HD2' ' A' 3573 ' ' TYR . 95.6 t -105.6 115.94 48.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.995 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.615 HG12 ' HG ' ' A' 3626 ' ' LEU . 60.2 mt -90.61 112.4 24.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.6 127.85 56.22 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.985 0.422 . . . . 0.0 111.721 -175.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 22.3 m -81.24 114.39 20.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.108 170.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 52.0 t . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.326 -0.845 . . . . 0.0 109.97 -174.422 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.54 ' CD1' ' HB2' ' A' 3553 ' ' MET . 69.8 m-85 . . . . . 0 N--CA 1.48 1.037 0 CA-C-O 119.754 -0.165 . . . . 0.0 111.418 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.628 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 38.6 mt-10 53.56 -157.44 0.17 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.719 0.771 . . . . 0.0 111.348 177.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 33.3 m -144.81 114.09 7.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 166.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.597 HD11 ' HD2' ' A' 3552 ' ' ARG . 0.5 OUTLIER -75.27 -127.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -176.896 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.514 ' N ' HD22 ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2523 ' ' ASP . . . . . 0.533 ' CG ' ' H ' ' B' 2524 ' ' SEP . 6.9 p-10 -124.37 -108.26 0.33 Allowed 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.76 -171.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B 2524 ' ' SEP . . . . . 0.533 ' H ' ' CG ' ' B' 2523 ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.861 -0.59 . . . . 0.0 110.694 -174.669 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.648 HG11 ' HB3' ' A' 3649 ' ' SER . 48.4 t . . . . . 0 N--CA 1.478 0.947 0 N-CA-C 110.373 -0.232 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -106.18 113.86 27.65 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.862 0.363 . . . . 0.0 110.253 177.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.433 ' O ' HD13 ' A' 3502 ' ' LEU . 4.6 mpp? -81.69 -11.77 58.93 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.524 -177.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.415 ' HA ' HD13 ' A' 3502 ' ' LEU . 58.6 t -65.45 -24.46 34.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 CA-C-O 121.305 0.574 . . . . 0.0 111.296 -176.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -79.31 -60.87 2.2 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.969 0.414 . . . . 0.0 110.677 176.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.59 HD11 ' HB2' ' A' 3646 ' ' LEU . 2.7 pp -61.97 -36.47 81.55 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -174.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.642 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.15 -15.84 63.01 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.467 -171.52 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.642 ' N ' HD12 ' A' 3502 ' ' LEU . 0.1 OUTLIER -72.17 -19.48 61.74 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3504 ' ' LYS . . . . . 0.653 ' HD2' ' N ' ' A' 3504 ' ' LYS . 0.0 OUTLIER -104.84 -42.38 5.37 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.073 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.724 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.5 103.04 3.48 Favored Pre-proline 0 N--CA 1.446 -0.631 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.214 178.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3506 ' ' PRO . . . . . 0.495 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 98.3 Cg_endo -84.99 174.96 6.95 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 124.369 3.38 . . . . 0.0 113.726 -177.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.528 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.1 mt -71.3 136.36 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.432 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3508 ' ' VAL . . . . . 0.401 HG12 ' HB2' ' A' 3526 ' ' PHE . 29.4 m -104.01 -22.85 4.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.344 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.595 ' CB ' HD11 ' A' 3538 ' ' LEU . 77.1 t-105 -157.73 150.23 22.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.734 -177.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -144.29 118.33 9.44 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.89 -129.53 1.09 Allowed Glycine 0 N--CA 1.441 -0.969 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 -177.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.595 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -141.64 151.46 43.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.186 0.517 . . . . 0.0 111.23 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.473 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.4 mt -105.2 148.79 26.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 169.443 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.666 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.55 124.95 13.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.691 0.281 . . . . 0.0 111.639 -177.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.821 HD13 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.56 142.42 41.34 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 173.839 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.821 ' CD ' HD13 ' A' 3515 ' ' LEU . 0.5 OUTLIER 60.38 -91.25 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.904 0.482 . . . . 0.0 109.98 -170.465 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -143.84 9.09 1.51 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -99.14 131.02 45.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.817 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 31.1 p -119.54 145.28 46.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.498 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -140.45 116.75 10.64 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.595 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.61 120.85 16.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.107 0.479 . . . . 0.0 110.078 177.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.415 ' HA ' ' O ' ' A' 3579 ' ' LEU . 27.5 m -128.87 148.57 33.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.562 0.696 . . . . 0.0 111.852 -175.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -110.31 125.48 53.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.986 -1.006 . . . . 0.0 108.621 172.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.6 HD23 HD13 ' A' 3576 ' ' LEU . 0.9 OUTLIER -96.89 107.82 20.4 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.227 0.537 . . . . 0.0 111.676 -175.378 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.528 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 62.6 m-70 -85.07 138.25 32.54 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.134 175.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.724 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.1 t80 -66.71 137.76 56.91 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 174.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.636 ' CG1' HD21 ' A' 3575 ' ' LEU . 21.0 t -114.94 -58.11 3.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.407 0.622 . . . . 0.0 110.617 176.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.477 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 67.5 m -158.99 172.16 18.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.079 -170.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.13 -156.64 28.59 Favored Glycine 0 N--CA 1.453 -0.186 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.776 177.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.529 ' HB2' ' HA ' ' A' 3571 ' ' THR . 37.9 t30 -100.23 110.92 23.18 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 6.6 p30 -62.89 -26.15 68.64 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.463 -175.678 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3532 ' ' VAL . . . . . 0.541 ' O ' ' HG2' ' A' 3536 ' ' ARG . 80.2 t -58.4 -35.42 54.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-O 120.787 0.327 . . . . 0.0 110.418 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.529 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 40.1 mt -58.19 -42.45 86.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.031 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.451 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.09 -41.83 94.63 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.954 0.407 . . . . 0.0 110.432 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 22.8 t60 -58.7 -41.59 86.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.854 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3536 ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' 3532 ' ' VAL . 14.2 ptp180 -89.5 -9.84 48.49 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.52 ' HB2' HD13 ' A' 3626 ' ' LEU . 33.7 p -99.82 -34.32 10.2 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.126 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.595 HD11 ' CB ' ' A' 3509 ' ' TRP . 21.7 mt -81.33 104.62 3.08 Favored Pre-proline 0 C--N 1.32 -0.698 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3539 ' ' PRO . . . . . 0.422 ' HD3' ' O ' ' A' 3537 ' ' SER . 57.3 Cg_endo -73.7 140.61 29.6 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 123.223 2.615 . . . . 0.0 114.763 -165.682 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.424 HD22 ' CZ3' ' A' 3509 ' ' TRP . 1.0 OUTLIER -159.42 149.87 19.24 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.243 -1.344 . . . . 0.0 110.451 172.275 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 68.3 m -161.55 -38.37 0.04 OUTLIER 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.986 -1.006 . . . . 0.0 108.974 172.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -145.17 98.03 3.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.051 178.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 87.83 -63.9 3.74 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.237 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 120.15 103.07 1.95 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.975 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3545 ' ' PRO . . . . . 0.447 ' HA ' ' HD3' ' A' 3546 ' ' PRO . 4.9 Cg_exo -77.21 150.04 28.74 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 123.234 2.623 . . . . 0.0 112.376 -178.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 12.1 Cg_exo -70.89 150.11 60.79 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.81 2.34 . . . . 0.0 111.963 176.306 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.589 ' HB3' HD11 ' A' 3612 ' ' ILE . 37.5 mt -81.58 115.73 21.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.912 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.666 ' HA ' ' O ' ' A' 3514 ' ' ALA . 29.1 ptt85 -90.45 140.46 29.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.2 -178.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.459 ' HA ' HG12 ' A' 3612 ' ' ILE . 17.6 mt -92.39 107.86 19.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 CA-C-O 121.944 0.878 . . . . 0.0 110.617 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.509 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.04 -3.17 14.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.064 -172.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.672 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 21.2 mt-30 -151.39 173.19 14.83 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.402 0.144 . . . . 0.0 111.127 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.679 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.42 139.65 17.54 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.847 0.356 . . . . 0.0 111.269 -179.658 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.575 ' O ' ' HA ' ' A' 3608 ' ' ALA . 16.5 ttt -109.17 142.67 39.64 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.101 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -77.66 110.94 12.93 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.628 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -76.86 97.76 4.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.109 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.608 ' HB2' ' HG2' ' A' 3559 ' ' GLN . 19.4 mm-40 -115.94 165.07 13.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.523 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.572 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.48 -54.6 38.8 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.176 0.297 . . . . 0.0 111.301 -178.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 27.0 p -62.48 -38.29 89.3 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 111.305 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.608 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 29.1 mm-40 -65.97 -46.86 76.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.995 -177.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' 3556 ' ' GLU . 92.0 mt -63.57 -32.01 73.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.084 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.6 mm-40 -65.34 -46.11 81.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.236 0.541 . . . . 0.0 109.952 175.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.17 99.64 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.099 176.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.532 ' O ' ' HG3' ' A' 3567 ' ' MET . 80.8 t -59.63 -45.67 94.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.903 0.382 . . . . 0.0 110.217 175.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.89 -30.04 68.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.737 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -62.35 -37.47 85.78 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -88.01 -7.79 56.56 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.646 176.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' 3563 ' ' VAL . 80.6 mtp -87.21 -24.25 24.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.619 177.591 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 31.0 p -81.87 -22.43 36.93 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.233 0.539 . . . . 0.0 110.275 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 39.7 t -93.26 80.41 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.644 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -67.21 109.2 2.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.01 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.529 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.0 m 151.77 -40.86 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.587 1.555 . . . . 0.0 108.016 -175.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -86.3 -17.51 34.41 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.689 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.762 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -136.2 163.12 31.11 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.028 0.442 . . . . 0.0 109.976 177.497 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.555 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 43.7 t -126.32 135.63 51.73 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 171.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.636 HD21 ' CG1' ' A' 3527 ' ' VAL . 14.8 tp -105.4 125.89 51.5 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.6 HD13 HD23 ' A' 3524 ' ' LEU . 73.5 mt -127.16 154.73 44.4 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.758 -177.348 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.779 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.4 OUTLIER -121.78 108.84 13.97 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.959 178.825 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.461 ' HB2' HD11 ' A' 3659 ' ' ILE . . . -94.75 123.16 38.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.384 0.611 . . . . 0.0 110.534 -178.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.433 ' HG ' HD12 ' A' 3577 ' ' LEU . 57.6 mt -125.28 145.57 51.19 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.205 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.22 116.02 2.98 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.415 2.077 . . . . 0.0 111.814 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.8 p -100.73 105.32 16.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.192 0.52 . . . . 0.0 110.842 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.13 145.79 16.15 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.36 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3583 ' ' ARG . . . . . 0.552 ' HG2' ' HB2' ' A' 3587 ' ' ASP . 9.0 ptp85 -61.44 -32.72 72.7 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.142 0.496 . . . . 0.0 110.993 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.572 ' O ' HG23 ' A' 3588 ' ' VAL . 2.8 p-10 -152.26 -179.45 7.55 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.799 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -49.52 -44.93 46.72 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.591 0.557 . . . . 0.0 111.479 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.93 -49.12 73.85 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 120.823 0.344 . . . . 0.0 110.773 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.552 ' HB2' ' HG2' ' A' 3583 ' ' ARG . 15.8 t0 -62.74 -42.92 99.9 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.968 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' 3584 ' ' ASP . 89.7 t -56.82 -49.35 79.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.674 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 70.9 t -62.19 -44.96 99.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.528 -179.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 32.6 t -61.06 -39.17 88.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.922 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3591 ' ' GLN . . . . . 0.461 ' HA ' ' OE1' ' A' 3591 ' ' GLN . 12.6 mm-40 -72.83 -35.59 67.31 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.576 178.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 63.9 m -61.01 -53.18 60.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.566 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3593 ' ' GLU . . . . . 0.517 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 11.1 pt-20 -63.17 -38.67 92.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.171 -178.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.1 m -65.88 -46.52 78.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 0.0 110.56 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.571 HD11 HD11 ' A' 3657 ' ' LEU . 62.1 tp -62.44 -45.89 91.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.264 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.838 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 62.7 pttt -70.1 -26.87 64.18 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.48 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.55 -39.47 20.35 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.929 0.395 . . . . 0.0 111.305 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.449 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -89.74 -46.07 8.86 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -172.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.486 ' HB2' HD13 ' A' 3595 ' ' LEU . 18.9 m-85 -99.37 -50.35 4.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.667 0.27 . . . . 0.0 111.619 -175.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.838 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.1 mm -62.15 -55.7 22.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 -176.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 90.4 m -58.04 -43.68 86.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.001 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.758 ' CE2' HD21 ' A' 3603 ' ' LEU . 0.1 OUTLIER -61.11 -56.93 15.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.895 -0.138 . . . . 0.0 110.782 177.722 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.758 HD21 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.7 -43.38 80.46 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -178.671 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -71.58 -38.63 70.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.774 0.321 . . . . 0.0 110.508 -176.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.72 67.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.942 0.401 . . . . 0.0 111.062 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3606 ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' A' 3602 ' ' TYR . 73.4 mmtt -83.18 -19.56 36.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.737 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3607 ' ' GLN . . . . . 0.581 ' O ' ' HG ' ' A' 3555 ' ' LEU . 28.0 mt-30 54.3 47.46 22.95 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -170.249 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.575 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -127.44 179.0 5.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.791 -171.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.679 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -117.7 118.16 31.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.02 171.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3610 ' ' GLY . . . . . 0.458 ' N ' HD12 ' A' 3603 ' ' LEU . . . -65.45 102.76 0.71 Allowed Glycine 0 C--O 1.221 -0.672 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.493 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.672 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 30.2 mm -88.88 119.89 36.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.229 0.537 . . . . 0.0 110.695 -175.155 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.589 HD11 ' HB3' ' A' 3547 ' ' LEU . 36.3 mt -114.86 106.53 20.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.165 176.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.439 ' HA ' ' O ' ' A' 3624 ' ' TYR . 7.7 m120 -84.49 129.06 34.89 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.869 176.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.45 HG21 ' O ' ' A' 3537 ' ' SER . 3.3 p -134.62 133.77 21.65 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.656 -178.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 74.1 Cg_endo -78.78 137.04 13.87 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.299 1.999 . . . . 0.0 112.353 175.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.706 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 11.1 t30 -67.2 121.81 80.07 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.901 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -48.9 121.16 6.26 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.386 2.724 . . . . 0.0 112.996 -175.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 95.28 -36.23 3.91 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.909 -0.663 . . . . 0.0 112.346 178.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 4.3 m -90.14 -28.45 18.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.863 0.363 . . . . 0.0 110.231 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 2.5 m-20 65.89 18.99 11.24 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.338 178.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.473 ' O ' ' HA ' ' A' 3615 ' ' PRO . 33.2 mt-30 -89.94 114.92 62.58 Favored Pre-proline 0 C--N 1.327 -0.41 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.484 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 91.9 Cg_endo -84.15 24.33 0.76 Allowed 'Trans proline' 0 CA--C 1.529 0.251 0 C-N-CA 123.406 2.737 . . . . 0.0 112.959 -175.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -79.41 37.75 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.99 0.424 . . . . 0.0 111.944 -176.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.706 ' HE2' ' HB2' ' A' 3616 ' ' ASN . 72.2 m-85 -123.9 132.86 53.81 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.084 177.023 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.453 HG13 HG23 ' A' 3611 ' ' ILE . 11.5 t -120.56 113.46 40.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.003 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.646 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -96.3 110.97 23.19 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 170.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.466 ' HB2' ' HB ' ' A' 3660 ' ' VAL . 44.0 mt-30 -94.1 111.9 23.66 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.205 -177.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.573 HG12 HG12 ' A' 3659 ' ' ILE . 37.1 mt -92.05 97.83 7.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.099 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -89.71 135.92 30.06 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.761 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.548 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 37.3 Cg_endo -66.38 171.02 11.1 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.819 2.346 . . . . 0.0 111.698 177.615 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.27 42.4 0.38 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.129 2.553 . . . . 0.0 113.126 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.404 ' H ' ' C ' ' A' 3630 ' ' PRO . 24.1 p -75.37 161.78 28.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.425 177.678 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -53.18 -35.73 60.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.516 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 24.2 t80 -53.01 -48.73 67.31 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.888 0.375 . . . . 0.0 111.059 176.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 10.8 m -67.05 -52.52 41.24 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.39 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -57.17 -43.56 82.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.676 -176.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 23.3 m -65.65 -46.35 79.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.035 0.445 . . . . 0.0 110.613 -177.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 8.0 m80 -63.69 -38.5 91.35 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.696 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 69.3 mt -65.76 -40.83 92.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.809 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.627 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 11.6 p -68.59 -27.09 65.74 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.841 -0.343 . . . . 0.0 110.822 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.3 -47.11 13.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 176.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.577 HD11 HD22 ' A' 3575 ' ' LEU . 20.8 mt -77.04 -40.95 44.46 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.394 -173.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.517 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -143.09 86.7 9.06 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-O 120.756 0.313 . . . . 0.0 111.216 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.37 -23.07 28.44 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.662 2.241 . . . . 0.0 113.475 -174.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 20.0 t0 -78.37 -49.41 13.61 Favored 'General case' 0 CA--C 1.516 -0.335 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.241 -174.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.779 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -72.3 -30.48 64.83 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.135 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.627 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -55.78 -45.89 78.06 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.131 177.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.06 -27.69 68.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.035 0.445 . . . . 0.0 111.206 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.648 ' HB3' HG11 ' A' 3496 ' ' VAL . 6.9 m -79.28 -39.3 33.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.705 178.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.557 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.6 pt -80.79 -11.72 12.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 120.903 0.382 . . . . 0.0 111.522 -174.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 45.5 m -57.94 -26.98 62.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.447 175.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -87.06 -34.74 19.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.368 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.557 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.1 tp -104.35 40.19 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-O 122.292 1.044 . . . . 0.0 109.635 -179.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.44 ' N ' ' HD2' ' A' 3655 ' ' PRO . 49.3 m -33.38 -44.66 0.46 Allowed Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 114.113 -1.403 . . . . 0.0 113.829 169.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.474 ' HG2' HD12 ' A' 3653 ' ' ILE . 13.5 Cg_endo -59.53 76.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 121.707 1.605 . . . . 0.0 111.819 169.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3656 ' ' HIS . . . . . 0.422 ' HB2' HD22 ' A' 3579 ' ' LEU . 18.5 p80 -146.22 174.06 11.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.781 -176.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.571 HD11 HD11 ' A' 3595 ' ' LEU . 36.5 mt -123.33 144.96 49.11 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.482 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 55.6 ttp -107.17 110.46 22.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.573 HG12 HG12 ' A' 3628 ' ' ILE . 88.9 mt -101.52 115.75 43.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.433 0.635 . . . . 0.0 111.32 -173.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.762 HG13 ' HD2' ' A' 3573 ' ' TYR . 90.8 t -102.75 112.03 34.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.615 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.646 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.7 mt -90.38 112.57 25.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.102 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -112.18 127.46 55.95 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.843 0.354 . . . . 0.0 110.953 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 15.1 p -94.62 109.63 21.53 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 172.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--O 1.249 1.073 0 CA-C-O 117.894 -1.051 . . . . 0.0 111.256 -175.916 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.475 ' CD1' ' HB2' ' A' 3553 ' ' MET . 46.7 m-85 . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.553 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.4 OUTLIER 55.37 -156.65 0.25 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.802 0.81 . . . . 0.0 111.879 174.495 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B 2520 ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' 3551 ' ' GLN . 4.2 t -153.45 127.01 8.69 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.321 -1.309 . . . . 0.0 107.682 167.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.552 HD11 ' H ' ' B' 2522 ' ' SEP . 0.2 OUTLIER -81.9 -127.68 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -177.307 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.662 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 13.8 t70 -169.14 -71.58 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.905 -177.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.252 -0.88 . . . . 0.0 109.431 174.253 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.719 HG11 ' HB3' ' A' 3649 ' ' SER . 45.9 t . . . . . 0 N--CA 1.477 0.924 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 29.8 t70 -104.78 120.21 40.83 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.985 0.421 . . . . 0.0 111.008 -178.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.465 ' O ' HD13 ' A' 3502 ' ' LEU . 3.1 mpp? -80.77 -24.24 38.77 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.93 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.474 ' HA ' HD13 ' A' 3502 ' ' LEU . 22.1 t -65.3 -25.06 36.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.18 0.514 . . . . 0.0 111.123 -174.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -77.35 -56.77 4.26 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.104 0.478 . . . . 0.0 110.76 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.503 HD11 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp -70.04 -32.33 70.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -170.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.6 HD11 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -71.2 -15.71 62.48 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.177 -174.786 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.6 ' N ' HD11 ' A' 3502 ' ' LEU . 52.3 tptt -71.04 -18.31 62.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.494 0.664 . . . . 0.0 109.46 177.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3504 ' ' LYS . . . . . 0.422 ' HB3' ' CE2' ' A' 3505 ' ' TYR . 29.2 mmtp -104.91 -44.65 4.77 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.92 174.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.688 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -151.87 105.6 2.85 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.553 -177.671 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 3506 ' ' PRO . . . . . 0.548 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 88.7 Cg_endo -83.69 173.73 9.19 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.952 3.101 . . . . 0.0 113.655 -175.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.588 HG12 ' CD2' ' A' 3525 ' ' HIS . 61.3 mt -71.56 132.03 33.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.524 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3508 ' ' VAL . . . . . 0.445 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.3 m -100.38 -31.34 3.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.587 -178.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.546 ' CB ' HD12 ' A' 3538 ' ' LEU . 51.4 t-105 -148.59 155.13 40.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 110.521 -177.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -149.02 120.04 7.69 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 176.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -169.58 -127.34 0.92 Allowed Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.623 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.2 mp -141.37 153.91 45.35 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.005 0.431 . . . . 0.0 110.82 178.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.463 HD21 ' HB2' ' A' 3547 ' ' LEU . 98.2 mt -107.78 150.83 26.51 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 169.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.738 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -147.83 124.5 11.13 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.779 0.323 . . . . 0.0 111.608 -178.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.676 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -136.41 139.58 42.55 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 174.256 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.741 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.0 OUTLIER 62.49 -95.26 0.05 OUTLIER 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 -167.634 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 14.0 m120 -140.16 6.6 2.16 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.188 176.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.494 ' O ' ' HA ' ' A' 3514 ' ' ALA . 11.9 m-20 -91.22 127.86 36.82 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.366 -174.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.469 HG22 ' HB1' ' A' 3514 ' ' ALA . 40.4 p -119.89 145.3 46.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.936 0.398 . . . . 0.0 111.627 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -142.87 120.16 11.56 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 174.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.617 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.93 118.6 16.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.964 0.412 . . . . 0.0 109.937 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.433 ' HA ' ' O ' ' A' 3579 ' ' LEU . 33.5 m -126.55 147.59 31.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.725 0.774 . . . . 0.0 112.525 -174.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -106.24 125.31 50.83 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.614 171.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.59 HD23 HD13 ' A' 3576 ' ' LEU . 0.9 OUTLIER -96.16 106.43 18.62 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.42 0.629 . . . . 0.0 111.176 -177.875 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.588 ' CD2' HG12 ' A' 3507 ' ' ILE . 29.1 m170 -82.96 138.79 33.67 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.407 176.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.688 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.8 t80 -68.93 137.28 53.68 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 174.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.625 ' CG1' HD21 ' A' 3575 ' ' LEU . 21.3 t -114.66 -56.52 4.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.447 0.641 . . . . 0.0 110.871 177.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.411 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 37.6 m -162.87 171.88 15.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.091 -171.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.61 -155.12 26.59 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.348 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3530 ' ' ASN . . . . . . . . . . . . . 39.2 t30 -100.18 113.82 26.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.619 0.247 . . . . 0.0 110.77 -178.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -64.12 -27.84 69.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.461 -177.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 49.4 t -60.33 -33.09 52.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.865 0.364 . . . . 0.0 110.362 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.447 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 23.0 mt -60.15 -39.76 87.49 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.968 178.041 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.442 ' HA ' HD11 ' A' 3661 ' ' ILE . . . -67.54 -41.36 84.41 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.542 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 32.3 t60 -64.33 -35.0 79.45 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.895 0.379 . . . . 0.0 110.723 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3536 ' ' ARG . . . . . 0.414 ' HD3' HD23 ' A' 3533 ' ' LEU . 13.3 ptm180 -89.25 -8.99 52.36 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -177.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.466 ' O ' HG21 ' A' 3614 ' ' VAL . 34.0 p -104.87 -39.89 6.13 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.557 177.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.546 HD12 ' CB ' ' A' 3509 ' ' TRP . 26.0 mt -80.69 109.34 12.75 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.039 0.447 . . . . 0.0 109.911 -174.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3539 ' ' PRO . . . . . 0.433 ' HD3' HG21 ' A' 3614 ' ' VAL . 61.1 Cg_endo -78.61 149.92 24.19 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.995 2.464 . . . . 0.0 113.057 -172.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -157.41 162.26 38.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.162 176.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 22.9 t -176.85 -45.09 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -143.31 114.54 7.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.145 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 68.03 -102.53 0.86 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.003 -178.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -169.46 102.66 0.18 Allowed Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 111.569 -0.612 . . . . 0.0 111.569 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.76 142.98 65.61 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.788 2.325 . . . . 0.0 112.605 -177.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.623 ' HA ' ' O ' ' A' 3512 ' ' LEU . 74.0 Cg_endo -79.64 123.09 5.21 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 122.51 2.14 . . . . 0.0 112.632 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.621 ' HB3' HD12 ' A' 3612 ' ' ILE . 55.3 mt -69.18 120.07 14.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.033 176.587 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.738 ' HA ' ' O ' ' A' 3514 ' ' ALA . 14.3 ptt180 -93.7 141.14 28.82 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.838 0.351 . . . . 0.0 111.285 -176.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.488 ' CG2' HD23 ' B' 2521 ' ' LEU . 25.2 mt -99.03 106.19 18.52 Favored 'Isoleucine or valine' 0 C--O 1.245 0.84 0 CA-C-O 121.922 0.867 . . . . 0.0 111.075 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.431 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.03 0.06 14.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.607 -174.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.622 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 23.1 mt-30 -148.55 175.31 11.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.514 178.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.79 ' HD3' ' HB2' ' B' 2521 ' ' LEU . 0.0 OUTLIER -159.85 140.11 11.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 111.752 -177.182 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.572 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -110.86 120.46 42.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.226 177.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.8 mmt180 -68.44 109.52 3.73 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.511 HD11 ' O ' ' A' 3555 ' ' LEU . 2.4 pp -71.56 98.3 1.85 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 122.209 1.004 . . . . 0.0 109.623 -177.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.507 ' O ' ' HG ' ' A' 3560 ' ' LEU . 36.3 mt-10 -108.87 164.72 12.14 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.026 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.617 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.16 -50.46 66.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.015 0.436 . . . . 0.0 110.214 179.183 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 3.0 p -60.5 -40.76 92.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.617 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.518 ' O ' HG22 ' A' 3563 ' ' VAL . 15.2 mm-40 -63.36 -50.1 71.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.697 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.507 ' HG ' ' O ' ' A' 3556 ' ' GLU . 85.0 mt -61.13 -31.88 71.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.297 -176.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.617 ' HG2' ' O ' ' A' 3557 ' ' ALA . 18.3 mm-40 -60.74 -50.85 71.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.226 0.536 . . . . 0.0 109.754 174.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3562 ' ' GLY . . . . . 0.412 ' HA2' ' HD2' ' A' 3565 ' ' ARG . . . -63.87 -39.64 97.56 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.168 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.555 ' O ' ' HG3' ' A' 3567 ' ' MET . 90.4 t -60.24 -48.54 87.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.59 0.234 . . . . 0.0 110.782 177.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.66 -30.35 68.68 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.574 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.515 ' HG3' ' O ' ' A' 3561 ' ' GLU . 99.7 mtt180 -57.64 -42.36 83.27 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.528 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.5 ptp180 -87.06 -13.59 43.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.949 0.404 . . . . 0.0 110.604 179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.555 ' HG3' ' O ' ' A' 3563 ' ' VAL . 85.6 mtp -79.53 -26.54 41.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.988 0.423 . . . . 0.0 110.593 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 15.1 t -85.0 1.37 47.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.188 0.518 . . . . 0.0 110.065 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 40.9 t -116.7 84.32 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.489 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.785 176.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -72.8 108.49 5.79 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3571 ' ' THR . . . . . . . . . . . . . 1.5 m 155.38 -43.52 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 O-C-N 124.998 1.436 . . . . 0.0 108.059 -173.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -86.65 -27.29 23.88 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.968 -177.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.76 ' HD2' HG11 ' A' 3660 ' ' VAL . 0.1 OUTLIER -129.41 162.08 28.87 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.939 178.215 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.585 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 48.8 t -124.41 136.91 54.43 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 170.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.625 HD21 ' CG1' ' A' 3527 ' ' VAL . 14.6 tp -105.85 125.44 50.99 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.59 HD13 HD23 ' A' 3524 ' ' LEU . 82.3 mt -127.11 153.21 46.3 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.111 0.481 . . . . 0.0 110.725 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.639 ' HG ' HD13 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.44 107.15 12.54 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.15 -179.538 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.459 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 124.01 38.16 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.416 0.627 . . . . 0.0 110.473 -177.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.458 HD21 ' HB2' ' A' 3656 ' ' HIS . 84.8 mt -125.42 146.31 53.97 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.155 -178.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.32 117.04 3.72 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.195 1.93 . . . . 0.0 111.88 176.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.2 p -107.21 106.7 17.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.286 0.565 . . . . 0.0 110.579 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.61 147.13 16.62 Favored Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.265 -179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -59.01 -35.03 72.56 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.254 0.55 . . . . 0.0 111.115 177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.55 ' O ' HG21 ' A' 3588 ' ' VAL . 10.3 t70 -142.84 174.19 10.88 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -55.93 -33.86 65.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 118.613 0.642 . . . . 0.0 109.916 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3586 ' ' GLU . . . . . 0.406 ' H ' ' HG3' ' A' 3586 ' ' GLU . 20.1 mt-10 -56.49 -54.68 42.93 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.379 175.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' 3591 ' ' GLN . 3.1 t70 -65.84 -36.04 82.35 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.718 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.55 HG21 ' O ' ' A' 3584 ' ' ASP . 99.2 t -57.49 -48.03 83.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.299 178.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 65.9 t -60.19 -44.06 94.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.02 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 43.7 t -60.7 -46.59 89.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.153 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3591 ' ' GLN . . . . . 0.493 ' HG2' ' O ' ' A' 3587 ' ' ASP . 70.9 mm-40 -65.15 -41.48 94.69 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 178.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 59.5 m -59.63 -53.28 59.83 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.959 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.39 -36.97 85.89 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.08 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 46.1 m -67.37 -44.52 78.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.883 0.373 . . . . 0.0 110.398 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.564 HD13 HD12 ' A' 3657 ' ' LEU . 46.5 tp -65.11 -46.4 81.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.983 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.765 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.93 -31.06 71.77 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.084 -176.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.09 -42.26 17.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.674 0.274 . . . . 0.0 111.363 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.414 ' HB2' ' HB3' ' A' 3518 ' ' ASP . . . -88.16 -45.67 9.92 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -170.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.498 ' HB2' HD11 ' A' 3595 ' ' LEU . 14.3 m-85 -99.48 -50.27 4.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.766 0.317 . . . . 0.0 111.245 -176.293 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.765 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 26.0 mm -61.56 -60.04 3.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.217 -175.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 88.8 m -59.08 -32.09 69.47 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 123.185 0.303 . . . . 0.0 111.238 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 42.1 t80 -77.09 -57.04 4.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.569 -177.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.528 HD13 ' O ' ' A' 3608 ' ' ALA . 0.4 OUTLIER -55.97 -38.62 70.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.235 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.39 -32.82 64.68 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.859 -0.337 . . . . 0.0 110.168 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.48 93.54 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.209 0.528 . . . . 0.0 110.689 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -81.38 -16.82 51.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.057 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3607 ' ' GLN . . . . . 0.417 ' O ' ' HG ' ' A' 3555 ' ' LEU . 55.1 mt-30 53.22 49.58 19.59 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -169.478 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.528 ' O ' HD13 ' A' 3603 ' ' LEU . . . -131.12 -178.78 4.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.334 0.588 . . . . 0.0 112.373 -171.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.742 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.81 118.35 30.59 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.572 176.112 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3610 ' ' GLY . . . . . 0.444 ' N ' HD12 ' A' 3603 ' ' LEU . . . -63.61 104.84 0.92 Allowed Glycine 0 C--O 1.222 -0.594 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.562 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.622 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.4 mm -89.6 121.67 40.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.207 0.527 . . . . 0.0 111.066 -175.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.621 HD12 ' HB3' ' A' 3547 ' ' LEU . 19.3 mt -117.07 113.01 41.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.024 177.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.44 ' HA ' ' O ' ' A' 3624 ' ' TYR . 38.1 m-80 -92.09 108.01 19.63 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.445 -179.234 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.466 HG21 ' O ' ' A' 3537 ' ' SER . 7.2 p -120.16 138.62 27.33 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.635 -171.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.704 ' HB2' ' HA ' ' A' 3620 ' ' ASN . 74.9 Cg_endo -81.73 141.51 12.25 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 122.556 2.17 . . . . 0.0 112.097 173.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.547 ' OD1' ' HB3' ' A' 3619 ' ' SER . 10.9 p30 -72.17 131.61 85.07 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 120.996 0.427 . . . . 0.0 111.064 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.51 122.78 12.17 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.899 2.399 . . . . 0.0 112.45 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 107.51 -42.56 1.9 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 121.088 -0.577 . . . . 0.0 112.706 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3619 ' ' SER . . . . . 0.547 ' HB3' ' OD1' ' A' 3616 ' ' ASN . 12.6 t -106.03 -28.96 10.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.73 0.3 . . . . 0.0 110.63 -176.108 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3620 ' ' ASN . . . . . 0.704 ' HA ' ' HB2' ' A' 3615 ' ' PRO . 3.6 m-20 66.32 30.42 8.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.372 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.524 ' O ' ' HA ' ' A' 3615 ' ' PRO . 97.8 mt-30 -83.62 112.97 43.97 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 173.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 89.6 Cg_endo -83.55 23.62 0.81 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.062 2.508 . . . . 0.0 113.453 -173.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -82.34 49.48 1.44 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.575 -177.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.44 ' O ' ' HA ' ' A' 3613 ' ' ASN . 82.7 m-85 -135.8 134.16 38.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.891 0.377 . . . . 0.0 110.726 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.429 HG13 HD13 ' A' 3611 ' ' ILE . 4.4 t -118.76 113.92 43.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.287 178.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.605 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.9 mp -97.83 115.53 28.24 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 169.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.545 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 44.0 mt-30 -94.72 111.44 23.22 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.702 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.594 HG12 HG12 ' A' 3659 ' ' ILE . 38.7 mt -90.16 98.59 8.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.254 178.696 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -86.83 139.72 33.05 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.096 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.405 ' C ' ' H ' ' A' 3632 ' ' CYS . 44.1 Cg_endo -67.94 172.81 10.19 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.695 2.263 . . . . 0.0 111.52 176.396 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.21 43.59 0.5 Allowed 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 122.892 2.395 . . . . 0.0 112.58 176.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.405 ' H ' ' C ' ' A' 3630 ' ' PRO . 24.5 p -74.82 162.84 28.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.767 179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -52.25 -40.75 62.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.202 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 31.3 t80 -50.43 -44.65 55.42 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.122 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.5 m -67.54 -56.92 7.58 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.655 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -57.11 -41.42 78.93 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.323 -0.399 . . . . 0.0 112.056 -175.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 12.0 p -66.83 -47.23 72.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.913 0.387 . . . . 0.0 110.869 -177.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 22.4 m-70 -66.9 -36.99 83.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.508 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 77.5 mt -61.89 -35.85 79.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.72 0.295 . . . . 0.0 110.819 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.874 ' HA ' HD21 ' A' 3647 ' ' LEU . 38.2 t -63.4 -37.77 88.58 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.182 0.515 . . . . 0.0 110.491 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3641 ' ' ARG . . . . . 0.611 ' NE ' ' HA ' ' A' 3641 ' ' ARG . 1.7 mmp_? -80.44 -32.23 37.34 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.011 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.588 HD11 HD23 ' A' 3575 ' ' LEU . 32.8 mt -96.63 -27.15 14.94 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -171.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.416 ' CB ' HG11 ' A' 3527 ' ' VAL . . . -159.32 79.69 2.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -178.081 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3644 ' ' PRO . . . . . 0.435 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 3.0 Cg_exo -73.75 -18.75 21.83 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.635 2.224 . . . . 0.0 111.546 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3645 ' ' ASP . . . . . 0.492 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 6.9 m-20 -69.52 -49.91 50.05 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.123 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.639 HD13 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -82.71 -25.01 33.35 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.278 179.147 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.874 HD21 ' HA ' ' A' 3640 ' ' SER . 34.8 tp -52.6 -49.69 64.53 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.581 178.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.52 -18.47 59.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.009 0.433 . . . . 0.0 111.632 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.719 ' HB3' HG11 ' A' 3496 ' ' VAL . 15.5 m -87.33 -38.26 16.39 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.59 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.532 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.0 pt -78.72 -21.76 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -175.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 47.2 m -52.39 -30.31 28.4 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 120.765 0.317 . . . . 0.0 111.326 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -82.96 -42.86 17.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.951 0.405 . . . . 0.0 109.954 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.532 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.6 tp -96.88 39.07 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-O 122.76 1.267 . . . . 0.0 109.168 -178.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.485 ' N ' ' HD2' ' A' 3655 ' ' PRO . 4.3 p -40.41 -37.26 0.84 Allowed Pre-proline 0 CA--C 1.545 0.766 0 CA-C-N 113.449 -1.705 . . . . 0.0 114.961 174.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.485 ' HD2' ' N ' ' A' 3654 ' ' SER . 22.9 Cg_endo -63.89 74.07 0.17 Allowed 'Trans proline' 0 C--N 1.358 1.038 0 CA-C-N 121.053 1.412 . . . . 0.0 111.529 170.13 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3656 ' ' HIS . . . . . 0.458 ' HB2' HD21 ' A' 3579 ' ' LEU . 18.1 p80 -139.36 173.78 11.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.323 -175.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.564 HD12 HD13 ' A' 3595 ' ' LEU . 32.3 mt -121.69 148.46 44.57 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.33 178.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.3 ttp -111.21 107.89 17.36 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 174.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.594 HG12 HG12 ' A' 3628 ' ' ILE . 74.9 mt -100.91 117.26 45.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.285 0.564 . . . . 0.0 111.524 -171.716 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.76 HG11 ' HD2' ' A' 3573 ' ' TYR . 56.5 t -101.76 115.93 44.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.147 -178.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.605 HG12 ' HG ' ' A' 3626 ' ' LEU . 68.0 mt -90.34 113.12 25.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 177.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -108.94 127.34 53.98 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.914 0.388 . . . . 0.0 110.851 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 32.0 t -93.47 136.4 33.78 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.69 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 5.1 m . . . . . 0 C--O 1.246 0.907 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.453 179.739 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.572 ' CD1' ' HB2' ' A' 3553 ' ' MET . 11.8 m-85 . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.606 ' HG2' ' H ' ' B' 2520 ' ' THR . 35.6 tt0 57.85 -163.34 0.2 Allowed 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 174.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 2520 ' ' THR . . . . . 0.606 ' H ' ' HG2' ' B' 2519 ' ' GLU . 41.3 m -150.56 124.23 9.13 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.79 ' HB2' ' HD3' ' A' 3552 ' ' ARG . 7.1 tp -90.35 -126.17 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.463 -179.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.741 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 4.2 t70 -165.57 -66.77 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.656 -177.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 . . . . . 0 C--O 1.248 0.981 0 CA-C-O 118.717 -0.659 . . . . 0.0 110.054 -175.824 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.663 HG13 ' HB3' ' A' 3649 ' ' SER . 47.6 t . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 37.7 t70 -95.42 111.58 23.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.024 0.44 . . . . 0.0 110.198 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.661 ' HG2' ' HB3' ' A' 3502 ' ' LEU . 51.5 ttp -80.95 -18.33 47.42 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.228 -176.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.404 ' HA ' HD13 ' A' 3502 ' ' LEU . 35.6 t -57.19 -24.69 21.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.303 0.573 . . . . 0.0 110.877 -178.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -78.12 -60.28 2.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.298 0.57 . . . . 0.0 110.566 173.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.658 HD11 ' HD1' ' A' 3525 ' ' HIS . 2.0 pp -71.34 -31.48 67.43 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -170.309 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.661 ' HB3' ' HG2' ' A' 3498 ' ' MET . 0.0 OUTLIER -67.48 -16.96 64.5 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.677 0.671 . . . . 0.0 110.278 -175.327 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.642 ' N ' HD12 ' A' 3502 ' ' LEU . 56.0 tptt -66.42 -25.8 66.92 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 121.358 0.599 . . . . 0.0 109.385 177.604 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 61.1 mmtt -105.58 -42.23 5.26 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.992 177.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.632 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.19 105.64 3.16 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 121.503 0.668 . . . . 0.0 111.521 -177.657 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -82.86 175.34 8.74 Favored 'Trans proline' 0 CA--C 1.533 0.43 0 C-N-CA 124.24 3.293 . . . . 0.0 113.248 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.479 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 90.9 mt -70.78 132.85 32.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.136 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3508 ' ' VAL . . . . . 0.498 HG12 ' HB2' ' A' 3526 ' ' PHE . 29.2 m -100.76 -26.39 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.189 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.65 ' CZ2' ' HA3' ' A' 3544 ' ' GLY . 43.2 t-105 -154.89 156.37 36.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.882 0.372 . . . . 0.0 110.779 -178.381 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3510 ' ' GLN . . . . . 0.455 HE21 ' HB3' ' A' 3510 ' ' GLN . 0.9 OUTLIER -151.29 119.22 6.21 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.74 -131.05 1.29 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.485 -0.646 . . . . 0.0 111.485 -176.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.61 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -140.55 150.38 43.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.217 0.532 . . . . 0.0 111.569 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.445 HD22 ' HB2' ' A' 3547 ' ' LEU . 83.1 mt -105.55 154.02 20.96 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 170.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -148.72 126.53 11.86 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.491 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.716 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.68 140.62 38.88 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 172.549 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.795 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.4 OUTLIER 62.52 -93.0 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -169.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 8.8 m120 -143.36 11.34 1.71 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 171.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.523 ' HB3' ' HB1' ' A' 3598 ' ' ALA . 27.9 m-20 -88.03 116.98 26.59 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.152 -176.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 21.8 p -110.54 133.42 53.31 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.91 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3520 ' ' ALA . . . . . 0.983 ' HB1' HE22 ' A' 3591 ' ' GLN . . . -135.11 120.1 18.63 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.379 177.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.61 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.93 117.76 16.09 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.209 0.528 . . . . 0.0 110.493 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.424 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 28.9 m -127.95 147.48 32.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.725 0.774 . . . . 0.0 112.126 -175.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -105.71 125.81 51.42 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.937 173.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.547 HD23 HD13 ' A' 3576 ' ' LEU . 2.0 mt -97.06 105.96 18.21 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.498 0.666 . . . . 0.0 111.573 -176.665 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.658 ' HD1' HD11 ' A' 3501 ' ' LEU . 26.0 m-70 -86.26 138.9 31.5 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.922 -1.035 . . . . 0.0 108.695 176.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.632 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.7 t80 -68.57 139.32 55.56 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.617 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.8 t -114.83 -55.67 4.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-O 121.298 0.57 . . . . 0.0 110.994 177.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 58.5 m -163.75 170.76 16.5 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.276 -172.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.87 -150.96 22.66 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.483 174.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.585 ' HB2' ' HA ' ' A' 3571 ' ' THR . 53.8 t-20 -93.45 107.74 19.53 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.342 -0.429 . . . . 0.0 110.553 -175.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -64.06 -30.82 71.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.634 0.254 . . . . 0.0 110.947 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 45.0 t -64.22 -31.57 53.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.955 0.407 . . . . 0.0 110.007 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.494 HD13 ' HB3' ' A' 3530 ' ' ASN . 16.6 mt -59.39 -40.2 85.81 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.774 176.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -66.87 -39.35 87.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.909 0.385 . . . . 0.0 110.267 179.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -61.35 -40.18 93.33 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -89.43 -10.13 47.62 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -176.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.639 ' O ' HG12 ' A' 3614 ' ' VAL . 77.5 p -103.87 -37.15 7.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.932 0.396 . . . . 0.0 111.416 -179.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.529 HD11 ' HB2' ' A' 3509 ' ' TRP . 21.1 mt -81.85 111.35 25.82 Favored Pre-proline 0 C--N 1.318 -0.783 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -65.93 131.83 28.42 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.439 2.093 . . . . 0.0 112.985 -174.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.416 ' O ' ' HB2' ' A' 3541 ' ' SER . 3.7 pp -156.2 152.74 28.2 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.131 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3541 ' ' SER . . . . . 0.416 ' HB2' ' O ' ' A' 3540 ' ' LEU . 38.9 t 169.64 -42.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.549 0.69 . . . . 0.0 109.228 -175.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.15 -8.11 5.92 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.32 -174.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 157.31 -27.66 0.49 Allowed Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.246 -177.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3544 ' ' GLY . . . . . 0.65 ' HA3' ' CZ2' ' A' 3509 ' ' TRP . . . 96.34 97.16 1.83 Allowed Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.453 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.71 147.23 94.99 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.863 2.376 . . . . 0.0 111.961 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.413 ' HA ' ' O ' ' A' 3512 ' ' LEU . 22.0 Cg_endo -62.04 134.84 51.67 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.591 2.194 . . . . 0.0 112.428 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.542 ' HB3' HD13 ' A' 3612 ' ' ILE . 65.4 mt -69.29 109.51 4.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.175 178.16 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.1 OUTLIER -90.51 134.82 34.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.879 0.371 . . . . 0.0 110.513 -177.784 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.462 HG12 HD12 ' A' 3612 ' ' ILE . 16.9 mt -90.52 107.29 18.3 Favored 'Isoleucine or valine' 0 C--O 1.248 0.997 0 CA-C-O 122.401 1.096 . . . . 0.0 111.061 -177.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.565 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -119.81 10.61 11.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.425 -174.325 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.776 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 32.1 mt-30 -154.49 167.68 29.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.832 -0.167 . . . . 0.0 110.558 179.316 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.706 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.41 143.27 14.85 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.869 0.366 . . . . 0.0 111.785 -177.221 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.545 ' O ' ' HA ' ' A' 3608 ' ' ALA . 12.4 tmm? -119.09 134.72 55.03 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.304 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -70.81 109.67 5.13 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.61 HD11 ' O ' ' A' 3555 ' ' LEU . 2.6 pp -74.57 98.23 3.33 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.115 0.96 . . . . 0.0 109.801 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3556 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -116.36 172.15 7.38 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.296 177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.62 68.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.693 0.282 . . . . 0.0 111.268 -176.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 60.1 p -71.11 -37.22 72.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.162 -178.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.483 ' HA ' ' OE1' ' A' 3559 ' ' GLN . 11.7 mm-40 -63.69 -49.51 72.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.536 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3560 ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.09 -35.79 79.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.029 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -66.65 -44.16 82.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.053 0.454 . . . . 0.0 110.586 174.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -52.53 -42.12 57.27 Favored Glycine 0 CA--C 1.518 0.254 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.993 173.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.523 ' O ' ' HG3' ' A' 3567 ' ' MET . 42.7 t -65.82 -49.6 76.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 174.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3564 ' ' ALA . . . . . 0.552 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.08 -27.2 63.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.817 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.536 ' O ' HG21 ' A' 3568 ' ' THR . 0.0 OUTLIER -58.57 -45.57 88.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.88 177.443 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -87.79 -4.44 58.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.074 0.464 . . . . 0.0 110.711 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.552 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 87.6 mtp -85.94 -15.88 40.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.141 178.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3568 ' ' THR . . . . . 0.536 HG21 ' O ' ' A' 3565 ' ' ARG . 11.6 t -85.95 3.13 43.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.11 0.481 . . . . 0.0 110.32 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 20.6 t -117.48 89.61 1.39 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.473 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.14 110.31 3.93 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.585 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.5 m 142.24 -42.97 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.774 1.629 . . . . 0.0 108.279 -177.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.24 -31.16 43.5 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.092 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.676 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -129.85 167.44 18.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.36 -0.382 . . . . 0.0 109.988 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.607 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 49.8 t -128.16 137.15 51.95 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.618 HD21 HD13 ' A' 3642 ' ' LEU . 14.1 tp -106.98 125.97 51.7 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 178.593 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.547 HD13 HD23 ' A' 3524 ' ' LEU . 75.6 mt -127.41 152.42 47.54 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.04 0.448 . . . . 0.0 110.911 -177.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.639 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.35 107.55 13.07 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.457 ' HB1' HD13 ' A' 3659 ' ' ILE . . . -94.66 119.2 32.93 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.376 0.608 . . . . 0.0 110.339 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.443 ' HG ' HD12 ' A' 3577 ' ' LEU . 48.2 mt -117.19 147.92 41.37 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.251 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3580 ' ' PRO . . . . . 0.434 ' HG2' HD13 ' A' 3653 ' ' ILE . 19.3 Cg_endo -60.45 123.06 12.3 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.234 1.956 . . . . 0.0 111.932 175.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.8 p -117.0 116.53 27.55 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.465 0.65 . . . . 0.0 110.887 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.66 146.77 16.5 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.948 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -62.78 -36.22 82.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.594 0.711 . . . . 0.0 109.226 178.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.576 ' O ' HG22 ' A' 3588 ' ' VAL . 16.9 t70 -131.23 166.17 21.75 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -55.85 -39.12 70.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.833 0.349 . . . . 0.0 110.648 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -66.42 -42.5 87.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.998 0.427 . . . . 0.0 110.37 177.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.4 ' HB3' ' H ' ' A' 3584 ' ' ASP . 24.1 t70 -61.42 -38.52 87.44 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.152 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.576 HG22 ' O ' ' A' 3584 ' ' ASP . 78.9 t -56.33 -47.41 81.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.44 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 83.0 t -59.42 -47.43 90.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.324 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 36.1 t -60.65 -45.5 93.86 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.162 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3591 ' ' GLN . . . . . 0.983 HE22 ' HB1' ' A' 3520 ' ' ALA . 25.9 tp60 -67.56 -41.58 83.98 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.826 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3592 ' ' THR . . . . . 0.513 ' O ' ' HG3' ' A' 3596 ' ' LYS . 87.7 m -57.6 -52.37 65.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.516 0.198 . . . . 0.0 110.991 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3593 ' ' GLU . . . . . 0.515 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 12.2 pt-20 -65.13 -31.13 72.16 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.759 0.314 . . . . 0.0 111.32 -178.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 48.9 m -68.71 -48.62 63.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.848 0.356 . . . . 0.0 110.38 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.551 HD12 HD12 ' A' 3657 ' ' LEU . 55.9 tp -62.19 -41.89 98.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.843 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.529 ' O ' ' HB ' ' A' 3600 ' ' ILE . 53.4 mtmt -57.77 -48.16 80.46 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.008 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -75.85 -39.57 56.33 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.523 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -86.97 -46.77 9.54 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -169.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.549 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 17.4 m-85 -99.51 -50.45 4.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.818 0.342 . . . . 0.0 111.283 -177.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.529 ' HB ' ' O ' ' A' 3596 ' ' LYS . 31.1 mm -61.07 -55.84 21.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.69 -175.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 48.0 m -60.48 -45.94 91.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.248 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.72 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.0 OUTLIER -60.14 -52.28 66.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.724 0.297 . . . . 0.0 110.648 179.193 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.72 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -67.78 -34.1 76.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.785 0.326 . . . . 0.0 110.833 -170.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -76.62 -38.89 53.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.139 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.94 -41.12 78.49 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 120.804 0.335 . . . . 0.0 110.936 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -78.32 -10.45 59.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.395 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3607 ' ' GLN . . . . . 0.411 ' O ' ' HG ' ' A' 3555 ' ' LEU . 43.0 mt-30 55.17 47.93 20.64 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.334 0.396 . . . . 0.0 111.017 178.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.545 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -133.88 171.43 14.19 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -171.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.706 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -104.4 117.82 35.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.213 170.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -67.78 104.37 1.15 Allowed Glycine 0 C--O 1.222 -0.598 0 C-N-CA 120.636 -0.793 . . . . 0.0 111.702 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.776 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 31.9 mm -90.38 131.24 38.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.073 0.463 . . . . 0.0 111.14 -174.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.542 HD13 ' HB3' ' A' 3547 ' ' LEU . 55.3 mt -131.46 108.83 15.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.039 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.68 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.0 m120 -81.06 136.47 35.96 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.25 0.547 . . . . 0.0 111.033 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.639 HG12 ' O ' ' A' 3537 ' ' SER . 21.3 t -128.55 136.21 28.77 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.807 -177.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.47 ' HA ' ' O ' ' A' 3621 ' ' GLN . 96.9 Cg_endo -83.46 135.82 7.26 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.199 1.933 . . . . 0.0 112.091 171.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.647 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 26.4 t-20 -67.8 129.16 93.4 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.409 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -57.08 108.07 0.33 Allowed 'Trans proline' 0 CA--C 1.53 0.282 0 C-N-CA 122.844 2.363 . . . . 0.0 112.702 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 107.32 -33.56 6.29 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.128 -0.558 . . . . 0.0 112.088 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3619 ' ' SER . . . . . 0.416 ' HB3' ' HB3' ' A' 3616 ' ' ASN . 30.9 t -95.89 -30.08 13.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.838 0.352 . . . . 0.0 110.45 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 65.4 t30 67.14 12.44 8.96 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.417 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.47 ' O ' ' HA ' ' A' 3615 ' ' PRO . 28.0 tt0 -68.82 110.66 6.37 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.451 177.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3622 ' ' PRO . . . . . . . . . . . . . 88.8 Cg_endo -84.1 22.96 0.87 Allowed 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.734 2.289 . . . . 0.0 112.506 -177.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3623 ' ' ALA . . . . . 0.46 ' H ' ' HG2' ' A' 3621 ' ' GLN . . . -83.26 46.95 1.18 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.296 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.68 ' O ' ' HA ' ' A' 3613 ' ' ASN . 62.0 m-85 -127.06 133.54 50.45 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.132 175.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.44 HG13 HG21 ' A' 3611 ' ' ILE . 3.8 t -125.2 113.71 36.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.003 177.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.615 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -96.74 112.19 24.05 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 169.576 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3627 ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -94.51 110.57 22.36 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -178.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.579 HG12 HG12 ' A' 3659 ' ' ILE . 32.9 mt -90.98 99.26 9.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.993 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 78.3 m-85 -89.83 138.44 27.88 Favored Pre-proline 0 C--N 1.318 -0.778 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.12 178.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.573 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 36.4 Cg_endo -65.53 169.57 12.49 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.556 2.171 . . . . 0.0 111.113 175.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.0 53.45 1.53 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 122.703 2.269 . . . . 0.0 112.51 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 26.0 p -81.03 162.63 23.71 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.429 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -52.2 -41.06 62.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.542 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 26.4 t80 -57.46 -44.73 85.03 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 14.6 m -61.58 -58.47 7.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.77 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -60.16 -37.87 81.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.465 -174.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 39.6 m -66.81 -49.97 64.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.838 0.352 . . . . 0.0 110.74 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -65.38 -32.63 74.37 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.554 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 50.8 mt -63.5 -35.19 79.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.365 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.637 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 19.3 t -72.04 -33.33 67.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.049 0.452 . . . . 0.0 110.148 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -78.97 -30.65 44.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.02 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.618 HD13 HD21 ' A' 3575 ' ' LEU . 22.4 mt -93.49 -38.84 11.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.893 -177.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.472 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -144.64 74.93 14.94 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -176.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -66.58 -17.8 53.38 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 122.485 2.123 . . . . 0.0 112.324 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3645 ' ' ASP . . . . . 0.597 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.3 m-20 -72.66 -50.01 27.89 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.338 -177.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.639 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -82.56 -27.04 31.85 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 178.38 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.637 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -53.49 -42.99 67.85 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.156 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -65.18 -17.97 64.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.635 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.663 ' HB3' HG13 ' A' 3496 ' ' VAL . 15.0 m -89.75 -34.19 16.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.923 0.392 . . . . 0.0 110.72 177.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.549 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.4 pt -85.52 -13.37 11.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -174.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 12.0 p -56.72 -31.31 64.4 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.192 0.52 . . . . 0.0 110.464 175.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 9.4 t30 -83.31 -36.74 24.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.673 174.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.549 HG22 ' HA ' ' A' 3650 ' ' ILE . 20.8 tt -104.59 45.17 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 122.741 1.258 . . . . 0.0 110.103 -177.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.462 ' N ' ' HD2' ' A' 3655 ' ' PRO . 19.9 m -33.7 -42.0 0.36 Allowed Pre-proline 0 CA--C 1.541 0.624 0 CA-C-N 113.403 -1.726 . . . . 0.0 113.845 166.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.524 ' HD2' ' C ' ' A' 3653 ' ' ILE . 23.6 Cg_endo -65.02 84.16 0.18 Allowed 'Trans proline' 0 C--N 1.359 1.123 0 CA-C-N 120.532 1.226 . . . . 0.0 111.715 173.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 28.6 p80 -152.15 173.35 15.06 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.137 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.551 HD12 HD12 ' A' 3595 ' ' LEU . 35.4 mt -121.98 142.27 50.49 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.165 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.6 ttp -105.16 111.23 23.9 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 176.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.579 HG12 HG12 ' A' 3628 ' ' ILE . 85.5 mt -103.61 119.59 52.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.264 0.554 . . . . 0.0 111.381 -172.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.676 HG13 ' HD2' ' A' 3573 ' ' TYR . 87.1 t -106.35 113.31 42.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.859 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.615 HG12 ' HG ' ' A' 3626 ' ' LEU . 46.8 mt -91.02 113.7 27.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.082 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.58 129.22 56.14 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.71 0.291 . . . . 0.0 111.503 -178.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 4.7 m -71.65 116.54 12.14 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 172.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 45.7 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.527 -0.749 . . . . 0.0 110.567 -177.578 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.518 ' CD1' ' HB2' ' A' 3553 ' ' MET . 22.9 m-85 . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 120.48 0.181 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.892 ' HG3' ' H ' ' B' 2520 ' ' THR . 2.4 tp10 57.69 -159.19 0.26 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.884 0.373 . . . . 0.0 110.281 175.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 2520 ' ' THR . . . . . 0.892 ' H ' ' HG3' ' B' 2519 ' ' GLU . 89.5 m -150.75 133.7 15.95 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 171.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.565 ' H ' ' C ' ' A' 3550 ' ' ALA . 35.7 tp -89.52 -121.05 0.06 Allowed 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.301 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.795 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B 2523 ' ' ASP . . . . . 0.538 ' HB2' ' H ' ' A' 3516 ' ' LYS . 43.5 t0 -163.13 96.32 0.88 Allowed 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 173.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.546 -177.781 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 3496 ' ' VAL . . . . . . . . . . . . . 34.7 m . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 120.981 0.42 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 22.2 t70 -107.04 152.53 23.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.483 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 2.8 tpp -63.38 -28.9 70.31 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -175.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 77.4 t -58.54 -24.53 25.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 CA-C-O 120.949 0.404 . . . . 0.0 111.925 -175.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -83.09 -57.57 3.22 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.399 177.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.555 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp -63.5 -35.69 81.29 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -173.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.626 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -68.12 -16.38 63.98 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.417 -172.307 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.626 ' N ' HD12 ' A' 3502 ' ' LEU . 0.7 OUTLIER -78.2 -21.03 50.67 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.18 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -98.7 -43.0 6.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.356 0.598 . . . . 0.0 109.74 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.702 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -147.51 100.15 3.81 Favored Pre-proline 0 N--CA 1.444 -0.739 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.773 179.934 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -82.71 173.89 10.03 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 123.985 3.123 . . . . 0.0 113.693 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 90.3 mt -71.23 133.73 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.047 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3508 ' ' VAL . . . . . 0.428 HG11 ' HB2' ' A' 3526 ' ' PHE . 27.0 m -101.95 -30.0 3.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.481 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.759 ' HE3' HD11 ' A' 3524 ' ' LEU . 26.1 t90 -147.04 154.64 41.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.652 0.263 . . . . 0.0 110.373 -174.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -150.59 121.55 7.66 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -175.78 -129.33 1.2 Allowed Glycine 0 N--CA 1.441 -0.976 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -178.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.614 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -140.13 152.18 45.9 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.076 0.465 . . . . 0.0 111.07 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.452 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.0 mt -105.69 149.72 26.12 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 168.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.698 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.55 125.97 14.02 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -177.192 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.726 HD11 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.86 144.89 41.63 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 172.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.726 ' CD ' HD11 ' A' 3515 ' ' LEU . 0.3 OUTLIER 62.63 -90.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.051 0.54 . . . . 0.0 110.337 -169.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -148.65 12.97 0.91 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.45 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.408 ' O ' ' HA ' ' A' 3514 ' ' ALA . 20.8 m-20 -106.01 144.06 33.26 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.76 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.454 HG23 ' HB1' ' A' 3514 ' ' ALA . 20.0 p -125.94 143.6 51.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.473 -177.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.67 115.06 13.36 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.256 174.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.614 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.44 116.34 12.77 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.956 0.407 . . . . 0.0 109.913 179.007 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.421 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -128.57 148.0 33.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 121.607 0.718 . . . . 0.0 111.75 -175.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -109.26 125.36 52.19 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.854 173.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.759 HD11 ' HE3' ' A' 3509 ' ' TRP . 1.0 OUTLIER -94.51 112.42 24.19 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.39 0.614 . . . . 0.0 111.86 -174.784 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.561 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 62.9 m-70 -88.15 138.53 31.36 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.799 176.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.702 ' O ' ' HB2' ' A' 3505 ' ' TYR . 66.2 t80 -67.28 138.18 56.66 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 174.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.614 ' CG1' HD22 ' A' 3575 ' ' LEU . 21.3 t -114.99 -58.38 3.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.177 0.513 . . . . 0.0 110.971 177.484 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.5 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 58.3 m -160.2 171.4 19.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.537 -171.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.61 -148.96 20.26 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.125 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.518 ' HB2' ' HA ' ' A' 3571 ' ' THR . 44.0 t-20 -108.23 118.53 37.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.945 0.402 . . . . 0.0 110.117 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.8 p30 -63.34 -28.21 69.85 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.907 -174.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 57.5 t -60.88 -33.47 55.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.752 0.311 . . . . 0.0 110.722 -177.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.516 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 19.7 mt -57.65 -42.68 83.97 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.076 177.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -68.38 -38.44 81.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.881 0.372 . . . . 0.0 110.907 -178.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 29.8 t60 -66.17 -36.48 83.22 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.612 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -89.73 -6.29 56.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.401 ' O ' HG23 ' A' 3614 ' ' VAL . 20.5 p -104.04 -43.34 5.3 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 122.005 -0.434 . . . . 0.0 111.271 176.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.534 HD13 ' HB2' ' A' 3509 ' ' TRP . 22.4 mt -79.36 110.81 16.5 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.982 0.42 . . . . 0.0 110.196 -173.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3539 ' ' PRO . . . . . 0.489 ' HD3' HG23 ' A' 3614 ' ' VAL . 36.6 Cg_endo -70.31 150.8 65.41 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.965 2.443 . . . . 0.0 112.87 -174.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.447 ' C ' ' HG ' ' A' 3541 ' ' SER . 1.4 pp -167.46 155.27 9.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.386 177.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3541 ' ' SER . . . . . 0.447 ' HG ' ' C ' ' A' 3540 ' ' LEU . 19.6 m -155.86 -45.11 0.08 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.319 175.7 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.81 -23.67 12.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.957 -1.019 . . . . 0.0 110.346 176.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 176.71 -42.06 0.1 Allowed Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 114.803 -1.09 . . . . 0.0 111.402 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 151.03 116.68 0.75 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.459 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3545 ' ' PRO . . . . . 0.466 ' HD2' ' O ' ' A' 3539 ' ' PRO . 74.4 Cg_endo -79.03 153.79 25.29 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 123.045 2.497 . . . . 0.0 112.108 177.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.594 ' HA ' ' O ' ' A' 3512 ' ' LEU . 29.0 Cg_endo -62.65 120.02 7.36 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.675 2.25 . . . . 0.0 113.211 -177.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.591 ' HB3' HD13 ' A' 3612 ' ' ILE . 39.1 mt -69.27 118.64 12.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.834 174.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.698 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -99.22 139.23 35.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 111.643 -174.342 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3549 ' ' ILE . . . . . . . . . . . . . 25.9 mt -95.6 107.83 20.16 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 121.603 0.716 . . . . 0.0 111.609 -175.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.627 ' HB3' ' HB2' ' B' 2525 ' ' GLU . . . -118.08 1.98 12.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.002 -175.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.658 ' HA ' ' HA ' ' B' 2520 ' ' THR . 62.4 mt-30 -145.64 171.43 14.73 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.527 -0.175 . . . . 0.0 110.527 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.781 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.2 138.89 11.66 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 120.73 0.3 . . . . 0.0 111.172 -179.691 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.562 ' HG3' ' CE1' ' B' 2518 ' ' TYR . 10.8 tmm? -109.67 132.27 54.3 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.116 -0.233 . . . . 0.0 110.885 -178.11 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3554 ' ' ARG . . . . . 0.425 HH11 ' HD3' ' A' 3554 ' ' ARG . 0.1 OUTLIER -63.71 109.03 1.57 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.181 -179.426 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.53 ' HB2' HD21 ' A' 3560 ' ' LEU . 3.5 pp -81.95 97.27 8.0 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 122.754 1.264 . . . . 0.0 109.411 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.452 ' H ' ' HB2' ' A' 3559 ' ' GLN . 13.9 mm-40 -111.4 166.49 11.08 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.741 -1.572 . . . . 0.0 108.855 177.661 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.486 ' O ' ' HG3' ' A' 3561 ' ' GLU . . . -54.02 -52.39 60.97 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.973 0.416 . . . . 0.0 111.038 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 25.5 p -65.6 -40.1 92.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.138 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.524 ' O ' HG21 ' A' 3563 ' ' VAL . 15.9 mm100 -65.03 -40.45 94.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.276 -179.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.53 HD21 ' HB2' ' A' 3555 ' ' LEU . 98.5 mt -62.85 -37.94 88.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.772 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' 3557 ' ' ALA . 12.8 mt-10 -68.65 -33.22 73.63 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 175.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3562 ' ' GLY . . . . . 0.466 ' O ' ' HB3' ' A' 3565 ' ' ARG . . . -64.75 -33.52 87.44 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.647 173.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.544 ' O ' ' HG2' ' A' 3566 ' ' ARG . 56.4 t -70.69 -45.75 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 174.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3564 ' ' ALA . . . . . 0.525 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.54 -27.03 64.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.122 178.736 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.466 ' HB3' ' O ' ' A' 3562 ' ' GLY . 75.5 ttt180 -55.3 -45.02 76.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.178 177.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3566 ' ' ARG . . . . . 0.544 ' HG2' ' O ' ' A' 3563 ' ' VAL . 9.2 ptp180 -87.2 -14.7 40.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.961 0.41 . . . . 0.0 110.844 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.525 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 78.0 mtp -83.3 -20.1 35.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.537 -176.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 11.2 t -88.1 4.04 46.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.959 0.409 . . . . 0.0 110.842 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 46.4 t -127.39 102.65 9.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-O 121.05 0.452 . . . . 0.0 110.748 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3570 ' ' GLU . . . . . 0.576 ' O ' ' HB ' ' A' 3571 ' ' THR . 1.7 mp0 -62.01 139.8 58.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.074 177.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.576 ' HB ' ' O ' ' A' 3570 ' ' GLU . 73.4 m 95.1 -27.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 O-C-N 124.199 0.937 . . . . 0.0 110.069 179.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.01 -31.57 50.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.72 171.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.719 ' HD2' HG11 ' A' 3660 ' ' VAL . 0.2 OUTLIER -138.28 167.17 22.42 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.048 177.708 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.602 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 29.4 t -129.11 135.99 49.62 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 171.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.691 HD11 ' HE2' ' A' 3573 ' ' TYR . 13.9 tp -106.58 126.31 52.11 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.466 HD11 HD22 ' A' 3524 ' ' LEU . 82.4 mt -128.17 151.79 48.82 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.596 -178.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.619 ' HG ' HD13 ' A' 3646 ' ' LEU . 0.3 OUTLIER -118.76 109.11 15.68 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.915 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.46 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.08 119.05 32.39 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.406 0.622 . . . . 0.0 110.469 -177.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.439 ' HG ' HD11 ' A' 3577 ' ' LEU . 82.9 mt -121.57 142.31 35.42 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.73 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.48 134.94 61.47 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.234 1.956 . . . . 0.0 111.359 177.077 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.2 p -124.52 114.53 19.55 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.142 0.496 . . . . 0.0 110.461 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.23 146.33 16.25 Favored Glycine 0 N--CA 1.443 -0.851 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.588 -178.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 13.1 mtm-85 -62.55 -48.87 77.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.757 0.789 . . . . 0.0 109.359 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.539 ' O ' HG22 ' A' 3588 ' ' VAL . 5.0 m-20 -125.87 174.95 8.01 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.177 -176.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -53.48 -48.4 68.95 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.347 0.404 . . . . 0.0 110.886 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -64.76 -38.96 92.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.58 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 27.8 t70 -65.15 -41.91 94.28 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.218 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.539 HG22 ' O ' ' A' 3584 ' ' ASP . 79.2 t -57.25 -43.61 82.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.501 176.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 11.7 t -62.49 -50.91 77.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.481 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 6.0 m -55.83 -48.58 75.2 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.363 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -64.28 -41.71 96.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.577 0.227 . . . . 0.0 110.848 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3592 ' ' THR . . . . . 0.447 ' O ' ' HG3' ' A' 3596 ' ' LYS . 28.8 m -62.06 -43.84 97.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.033 0.444 . . . . 0.0 109.876 176.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -59.67 -51.08 71.32 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.98 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 32.4 m -59.37 -44.97 92.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.686 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.583 HD12 HD12 ' A' 3657 ' ' LEU . 48.0 tp -62.38 -43.34 99.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.917 -178.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.507 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 55.4 mtmt -59.68 -51.73 68.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.624 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -69.77 -33.63 72.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.291 -175.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -95.45 -46.78 6.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -171.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.477 ' HB2' HD11 ' A' 3595 ' ' LEU . 27.3 m-85 -100.3 -51.03 3.75 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 -174.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.507 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.9 mm -62.38 -60.54 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.359 -173.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 88.0 m -58.0 -39.71 78.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.394 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.621 ' HH ' ' HE3' ' A' 3606 ' ' LYS . 45.6 t80 -71.74 -56.15 6.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.529 -176.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.536 HD11 ' O ' ' A' 3608 ' ' ALA . 0.3 OUTLIER -56.24 -39.81 73.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.726 -0.216 . . . . 0.0 111.329 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -75.88 -30.52 58.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.766 0.317 . . . . 0.0 110.297 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -65.79 -38.69 89.7 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.408 0.623 . . . . 0.0 110.248 176.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3606 ' ' LYS . . . . . 0.621 ' HE3' ' HH ' ' A' 3602 ' ' TYR . 72.2 mmtt -79.5 -18.9 50.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.953 178.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3607 ' ' GLN . . . . . 0.437 ' O ' ' HG ' ' A' 3555 ' ' LEU . 52.5 mt-30 51.26 51.11 17.6 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -170.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.536 ' O ' HD11 ' A' 3603 ' ' LEU . . . -133.23 -177.68 4.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.739 -174.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.781 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -117.7 118.33 31.8 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.131 176.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3610 ' ' GLY . . . . . 0.523 ' N ' HD12 ' A' 3603 ' ' LEU . . . -64.2 104.18 0.85 Allowed Glycine 0 C--O 1.223 -0.548 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.492 178.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.641 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 37.3 mm -90.0 123.36 42.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.188 0.518 . . . . 0.0 110.95 -175.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.591 HD13 ' HB3' ' A' 3547 ' ' LEU . 40.6 mt -118.52 105.96 18.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.83 175.318 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.46 ' HA ' ' O ' ' A' 3624 ' ' TYR . 11.7 m120 -84.74 109.33 17.97 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.233 178.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.489 HG23 ' HD3' ' A' 3539 ' ' PRO . 10.7 p -116.2 136.8 23.09 Favored Pre-proline 0 C--N 1.314 -0.975 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.982 -172.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.545 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 60.6 Cg_endo -75.94 141.18 23.75 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.374 2.05 . . . . 0.0 113.012 176.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.501 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 6.9 t30 -73.14 121.87 86.2 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.055 176.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.45 128.5 15.08 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.653 2.902 . . . . 0.0 113.085 -177.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 96.2 -36.55 3.8 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.1 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 33.2 t -98.95 -28.52 13.39 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.614 0.245 . . . . 0.0 110.662 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3620 ' ' ASN . . . . . 0.491 ' HA ' ' HB2' ' A' 3615 ' ' PRO . 35.5 m-20 62.6 21.32 12.6 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.099 -176.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.505 ' OE1' ' HD2' ' A' 3622 ' ' PRO . 6.5 tp-100 -85.85 108.32 16.32 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.806 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.545 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 74.9 Cg_endo -76.64 24.58 0.46 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.339 2.692 . . . . 0.0 113.479 -176.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -77.4 48.77 0.67 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.033 0.444 . . . . 0.0 111.564 -177.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.501 ' HE2' ' HB2' ' A' 3616 ' ' ASN . 70.7 m-85 -139.34 133.86 31.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.082 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.442 HG11 HD13 ' A' 3611 ' ' ILE . 4.1 t -117.14 115.64 49.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.166 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.614 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -99.31 112.96 25.02 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 170.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.41 ' O ' ' HA ' ' A' 3659 ' ' ILE . 13.5 mt-30 -94.16 111.06 22.76 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.664 -177.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.585 HG12 HG12 ' A' 3659 ' ' ILE . 47.3 mt -93.97 99.46 9.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.548 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -91.17 138.49 25.79 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.451 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.34 168.32 22.65 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.786 2.324 . . . . 0.0 111.677 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -64.81 81.52 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.805 2.337 . . . . 0.0 112.243 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 7.9 p -111.84 162.08 15.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.017 -176.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3633 ' ' GLU . . . . . 0.423 ' CD ' ' H ' ' A' 3633 ' ' GLU . 1.7 mp0 -54.72 -37.84 66.35 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.151 -179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3634 ' ' PHE . . . . . 0.413 ' CE2' ' HB3' ' A' 3560 ' ' LEU . 31.9 t80 -65.87 -42.78 89.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.097 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 67.1 p -62.86 -54.08 44.27 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.968 -178.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3636 ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' 3633 ' ' GLU . 0.6 OUTLIER -59.55 -38.14 80.29 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.643 0.258 . . . . 0.0 111.375 -179.364 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 48.1 t -56.71 -53.19 60.63 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.816 178.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -74.3 -30.57 62.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.949 -178.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3639 ' ' LEU . . . . . 0.446 ' HB3' HD23 ' A' 3647 ' ' LEU . 49.2 mt -62.53 -39.64 94.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.444 0.164 . . . . 0.0 110.891 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.514 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 24.3 m -63.97 -39.66 94.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.198 0.523 . . . . 0.0 110.54 177.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -72.07 -43.4 64.94 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.675 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.588 HD11 HD23 ' A' 3575 ' ' LEU . 20.0 mt -83.5 -42.03 17.33 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.442 -173.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.468 ' HB3' ' CZ ' ' A' 3505 ' ' TYR . . . -142.63 83.5 11.7 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.828 0.347 . . . . 0.0 111.438 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.73 -26.03 28.14 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.666 2.244 . . . . 0.0 113.307 -175.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 5.6 t0 -71.84 -47.83 50.38 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -173.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.619 HD13 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.03 -29.37 49.35 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.359 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.514 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.14 -51.58 63.81 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.892 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.03 -25.4 66.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.933 0.397 . . . . 0.0 111.136 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 17.6 m -79.36 -36.35 39.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.029 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.503 ' HA ' HG21 ' A' 3653 ' ' ILE . 5.4 pt -81.42 -10.44 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.237 0 CA-C-O 120.755 0.312 . . . . 0.0 111.349 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 9.4 t -59.08 -26.53 64.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.142 0.496 . . . . 0.0 109.701 174.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 13.9 m120 -79.68 -41.21 27.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.326 0.584 . . . . 0.0 110.111 175.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.503 HG21 ' HA ' ' A' 3650 ' ' ILE . 8.6 tp -105.29 40.32 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 122.22 1.01 . . . . 0.0 109.821 -177.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.497 ' N ' ' HD2' ' A' 3655 ' ' PRO . 50.8 m -40.43 -40.61 2.08 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-N 114.521 -1.218 . . . . 0.0 113.6 173.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.497 ' HD2' ' N ' ' A' 3654 ' ' SER . 14.9 Cg_endo -60.24 78.57 0.07 OUTLIER 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 121.568 1.512 . . . . 0.0 111.864 169.065 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3656 ' ' HIS . . . . . 0.422 ' CB ' HD21 ' A' 3579 ' ' LEU . 32.6 p80 -150.46 -178.64 6.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.636 -179.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.583 HD12 HD12 ' A' 3595 ' ' LEU . 24.0 mt -124.74 142.59 51.3 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.71 -178.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 61.2 ttp -102.69 110.99 23.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.585 HG12 HG12 ' A' 3628 ' ' ILE . 84.0 mt -103.88 121.29 55.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-O 121.306 0.574 . . . . 0.0 111.492 -173.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.719 HG11 ' HD2' ' A' 3573 ' ' TYR . 85.1 t -107.27 116.4 50.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.661 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.614 HG12 ' HG ' ' A' 3626 ' ' LEU . 64.3 mt -90.81 112.19 24.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 177.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -108.52 128.52 54.88 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.881 0.372 . . . . 0.0 111.322 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 9.2 m -68.95 114.63 7.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.005 174.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 63.2 t . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.914 -0.565 . . . . 0.0 110.155 179.196 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.562 ' CE1' ' HG3' ' A' 3553 ' ' MET . 8.0 m-85 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 111.172 0.064 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.566 ' HG2' ' H ' ' B' 2520 ' ' THR . 15.7 tt0 57.01 -158.74 0.26 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 177.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 2520 ' ' THR . . . . . 0.658 ' HA ' ' HA ' ' A' 3551 ' ' GLN . 8.0 t -157.44 124.55 5.13 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 172.476 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.634 HD22 ' H ' ' B' 2522 ' ' SEP . 0.4 OUTLIER -82.02 -129.15 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.634 ' H ' HD22 ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 24.9 t70 -166.0 -70.12 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.683 178.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B 2525 ' ' GLU . . . . . 0.627 ' HB2' ' HB3' ' A' 3550 ' ' ALA . 38.8 mt-10 . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.447 -0.787 . . . . 0.0 110.363 177.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.567 ' HA ' ' HA ' ' A' 3649 ' ' SER . 8.8 p . . . . . 0 N--CA 1.483 1.185 0 CA-C-O 121.473 0.654 . . . . 0.0 110.494 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3497 ' ' ASP . . . . . 0.474 ' OD2' ' HG3' ' A' 3500 ' ' GLN . 29.0 t70 -79.57 121.13 24.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.245 -174.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.504 ' HA ' ' CD2' ' A' 3501 ' ' LEU . 69.6 mtm -82.7 -13.1 56.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.858 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 45.6 t -73.8 -23.88 19.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.311 0.577 . . . . 0.0 111.092 -176.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3500 ' ' GLN . . . . . 0.474 ' HG3' ' OD2' ' A' 3497 ' ' ASP . 54.0 mt-30 -80.17 -48.11 13.66 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 122.085 -0.385 . . . . 0.0 110.507 176.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.591 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.3 pp -66.05 -37.18 85.18 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -174.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.712 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -71.82 -13.65 61.75 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.429 -173.301 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.536 ' N ' HD11 ' A' 3502 ' ' LEU . 51.4 tptt -67.64 -23.7 65.37 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 174.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3504 ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' 3504 ' ' LYS . 36.0 mmtm -103.27 -42.66 5.67 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.261 176.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.674 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -146.87 103.08 3.88 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-O 121.471 0.653 . . . . 0.0 110.796 179.252 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3506 ' ' PRO . . . . . 0.712 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 94.0 Cg_endo -82.11 174.39 10.1 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 123.972 3.115 . . . . 0.0 113.556 -176.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.51 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 82.1 mt -71.22 133.12 32.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.536 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3508 ' ' VAL . . . . . 0.446 HG12 ' HB2' ' A' 3526 ' ' PHE . 33.8 m -101.89 -24.55 4.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.364 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.591 ' CB ' HD11 ' A' 3538 ' ' LEU . 50.4 t-105 -156.13 154.73 31.34 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.805 0.336 . . . . 0.0 110.786 -176.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -147.57 120.08 8.5 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -171.1 -132.92 1.54 Allowed Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.723 -177.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.546 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -139.83 149.0 42.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.182 0.515 . . . . 0.0 111.546 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.464 HD23 ' HB2' ' A' 3547 ' ' LEU . 93.8 mt -105.1 144.38 31.97 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 170.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.684 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -141.98 124.44 15.74 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.738 0.304 . . . . 0.0 111.61 -177.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.681 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.31 146.37 44.54 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 173.903 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.681 ' CD ' HD12 ' A' 3515 ' ' LEU . 1.2 mptm? 62.64 -93.69 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -167.066 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 22.4 m120 -147.26 11.95 1.04 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.343 175.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.443 ' O ' ' HA ' ' A' 3514 ' ' ALA . 3.9 t0 -100.09 138.72 36.78 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.129 -175.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.555 HG23 ' HB2' ' A' 3514 ' ' ALA . 28.0 p -123.58 127.69 48.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.087 0.47 . . . . 0.0 111.88 -175.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -120.71 115.64 23.72 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.395 175.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.546 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.75 120.78 18.85 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.428 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -130.38 147.93 33.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.538 0.685 . . . . 0.0 111.834 -175.255 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -111.1 126.09 54.46 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.986 173.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.567 HD21 HD11 ' A' 3576 ' ' LEU . 0.8 OUTLIER -95.51 112.63 24.31 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.34 0.59 . . . . 0.0 111.986 -173.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.51 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 74.9 m-70 -85.53 140.28 30.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.757 174.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.674 ' O ' ' HB2' ' A' 3505 ' ' TYR . 58.9 t80 -70.17 136.64 50.28 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 175.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.646 ' CG1' HD23 ' A' 3575 ' ' LEU . 19.6 t -115.36 -51.96 4.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.081 0.467 . . . . 0.0 111.372 178.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 25.8 t -162.19 170.39 19.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.706 -170.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.25 -149.21 21.19 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.854 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.5 t-20 -104.7 117.02 33.05 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.773 0.32 . . . . 0.0 110.713 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 12.2 p30 -61.15 -36.28 79.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3532 ' ' VAL . . . . . 0.422 HG13 ' HD2' ' A' 3536 ' ' ARG . 57.8 t -59.95 -33.41 52.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.559 0.218 . . . . 0.0 110.489 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.51 HD21 ' HD3' ' A' 3536 ' ' ARG . 16.4 mt -56.7 -40.99 76.6 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.235 178.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.423 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.81 -47.26 72.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.885 0.374 . . . . 0.0 110.378 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -59.89 -35.59 75.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.946 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3536 ' ' ARG . . . . . 0.51 ' HD3' HD21 ' A' 3533 ' ' LEU . 12.4 ptm180 -88.95 -11.09 45.37 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.02 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.505 ' O ' HG22 ' A' 3614 ' ' VAL . 57.5 p -103.05 -37.52 7.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.976 0.417 . . . . 0.0 111.227 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.591 HD11 ' CB ' ' A' 3509 ' ' TRP . 21.3 mt -78.88 112.01 24.14 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -174.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -66.45 139.84 55.48 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 123.255 2.636 . . . . 0.0 113.989 -166.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.409 ' C ' ' HG ' ' A' 3541 ' ' SER . 2.3 pp -156.77 153.13 27.85 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.161 176.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3541 ' ' SER . . . . . 0.409 ' HG ' ' C ' ' A' 3540 ' ' LEU . 51.0 m -164.82 -46.61 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.44 178.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -116.15 -47.37 2.77 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.718 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . -147.75 -58.44 0.01 OUTLIER Glycine 0 C--N 1.311 -0.856 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.617 178.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 161.02 99.18 0.14 Allowed Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.234 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -72.42 141.93 36.01 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.459 2.106 . . . . 0.0 111.2 176.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.41 143.2 62.61 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.625 2.217 . . . . 0.0 112.614 -176.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.555 ' HB3' HD11 ' A' 3612 ' ' ILE . 57.0 mt -78.0 118.05 19.91 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.264 177.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.684 ' HA ' ' O ' ' A' 3514 ' ' ALA . 23.8 ptt180 -103.52 141.62 35.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.074 0.464 . . . . 0.0 111.401 -177.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.457 HD12 HD11 ' A' 3628 ' ' ILE . 19.5 mt -94.12 107.23 19.04 Favored 'Isoleucine or valine' 0 C--O 1.254 1.326 0 CA-C-O 122.705 1.24 . . . . 0.0 111.648 -172.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.419 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -108.94 -6.52 15.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.891 -173.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.648 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 52.6 mt-30 -148.29 176.95 9.83 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.363 0.125 . . . . 0.0 111.142 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.71 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -155.83 136.79 13.62 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.884 0.374 . . . . 0.0 111.585 -178.945 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.593 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 14.1 tmm? -110.39 121.67 45.85 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.398 177.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -71.78 110.64 6.45 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.532 ' HB2' HD22 ' A' 3560 ' ' LEU . 2.9 pp -71.98 98.65 2.09 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 122.278 1.037 . . . . 0.0 110.054 -176.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.597 ' O ' ' HG ' ' A' 3560 ' ' LEU . 43.4 mt-10 -113.09 166.42 11.45 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.309 176.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -53.24 -47.48 68.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.063 0.459 . . . . 0.0 111.11 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 1.6 p -63.04 -38.39 91.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.507 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.854 HE21 ' HA ' ' A' 3559 ' ' GLN . 0.0 OUTLIER -74.27 -37.59 63.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.168 -177.521 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' 3556 ' ' GLU . 86.0 mt -61.72 -35.32 77.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.729 0.3 . . . . 0.0 110.488 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -62.85 -46.17 89.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.961 173.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -62.32 -34.07 88.1 Favored Glycine 0 CA--C 1.519 0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.499 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.567 ' O ' ' HG3' ' A' 3567 ' ' MET . 59.2 t -66.87 -49.5 73.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3564 ' ' ALA . . . . . 0.547 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.74 -27.54 68.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.063 178.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -54.76 -47.34 74.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.533 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.2 ptp85 -85.17 -14.41 47.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.078 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.567 ' HG3' ' O ' ' A' 3563 ' ' VAL . 87.6 mtp -83.08 -19.58 36.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.804 0.335 . . . . 0.0 111.153 -179.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3568 ' ' THR . . . . . 0.436 HG23 ' O ' ' A' 3564 ' ' ALA . 37.0 p -80.36 -21.45 42.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.144 0.497 . . . . 0.0 110.549 177.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 23.3 t -106.19 78.65 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.572 177.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.66 108.21 1.99 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.665 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.557 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.7 m 155.96 -45.85 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.373 1.469 . . . . 0.0 107.732 -173.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -86.76 -14.86 41.11 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.295 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.645 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -134.81 162.88 31.12 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.758 175.475 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.581 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 34.2 t -128.23 133.94 48.92 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.312 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.646 HD23 ' CG1' ' A' 3527 ' ' VAL . 12.6 tp -105.61 125.41 50.96 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.567 HD11 HD21 ' A' 3524 ' ' LEU . 81.4 mt -125.78 154.52 42.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.85 -177.024 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.716 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.72 108.14 13.62 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.186 179.76 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.494 ' HB2' HD11 ' A' 3659 ' ' ILE . . . -94.28 123.64 37.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.236 0.541 . . . . 0.0 110.591 -178.08 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.417 ' O ' ' HA ' ' A' 3522 ' ' VAL . 73.7 mt -124.63 143.71 44.22 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.258 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.47 117.96 4.78 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.46 2.107 . . . . 0.0 112.21 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.7 p -110.08 119.62 39.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.127 0.489 . . . . 0.0 110.029 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -102.82 145.19 16.27 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.735 -177.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 44.3 mtm180 -70.52 -25.18 63.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.782 0.801 . . . . 0.0 109.87 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.565 ' O ' HG23 ' A' 3588 ' ' VAL . 23.9 t70 -147.9 169.95 18.72 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.354 -1.294 . . . . 0.0 108.257 -175.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.53 -49.59 67.3 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -60.93 -37.96 84.14 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.688 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.497 ' O ' ' HG2' ' A' 3591 ' ' GLN . 6.4 t70 -66.97 -40.83 87.53 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.548 -177.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' 3584 ' ' ASP . 94.1 t -58.68 -39.49 76.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.178 0.514 . . . . 0.0 110.385 178.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 3.0 t -63.49 -48.27 87.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.457 177.547 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 71.9 m -58.72 -47.31 85.02 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 114.178 -1.374 . . . . 0.0 111.703 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3591 ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' 3587 ' ' ASP . 71.6 mm-40 -63.87 -45.08 91.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.478 0.18 . . . . 0.0 110.758 -179.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 46.3 m -57.59 -47.4 82.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.16 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.91 -50.7 72.37 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.887 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 19.4 m -60.65 -45.25 94.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.187 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.558 HD13 HD13 ' A' 3657 ' ' LEU . 44.8 tp -64.08 -45.93 86.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.568 -175.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.779 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -71.29 -25.55 62.49 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.061 -176.164 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.55 -40.56 18.96 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.403 178.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.48 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -92.36 -45.97 7.92 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -171.105 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.506 ' HB2' HD12 ' A' 3595 ' ' LEU . 21.1 m-85 -98.47 -50.17 4.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.256 -174.438 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.779 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 21.8 mm -61.46 -58.09 9.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.738 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 98.0 m -55.57 -41.06 72.77 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 123.352 0.407 . . . . 0.0 111.456 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.779 ' CE2' HD21 ' A' 3603 ' ' LEU . 0.1 OUTLIER -68.48 -56.98 6.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.614 -0.267 . . . . 0.0 111.333 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.779 HD21 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.52 -43.55 79.89 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.526 0.203 . . . . 0.0 111.521 -177.182 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -68.07 -37.29 81.1 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.496 -177.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.25 -37.3 77.88 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.038 0.447 . . . . 0.0 110.822 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -77.35 -18.6 57.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.824 179.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 50.03 53.03 13.54 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -169.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.438 ' O ' HD13 ' A' 3603 ' ' LEU . . . -135.69 -176.02 4.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.312 -171.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.71 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.05 118.26 30.15 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.499 176.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3610 ' ' GLY . . . . . 0.437 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.93 103.78 0.84 Allowed Glycine 0 C--O 1.222 -0.605 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.485 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.648 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 31.0 mm -88.99 120.37 37.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.175 0.512 . . . . 0.0 111.055 -174.102 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.555 HD11 ' HB3' ' A' 3547 ' ' LEU . 35.0 mt -119.24 117.83 55.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.879 176.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.534 ' HA ' ' O ' ' A' 3624 ' ' TYR . 15.9 m120 -96.73 126.04 41.62 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.348 -178.083 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.564 HG21 ' HB2' ' A' 3624 ' ' TYR . 3.4 m -119.56 158.61 48.78 Favored Pre-proline 0 C--N 1.32 -0.691 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 176.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.62 ' HA ' ' O ' ' A' 3621 ' ' GLN . 20.5 Cg_endo -61.64 140.99 89.56 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.343 2.029 . . . . 0.0 113.914 -179.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.568 ' HB2' ' CD2' ' A' 3624 ' ' TYR . 40.9 t30 -138.82 92.59 11.14 Favored Pre-proline 0 C--O 1.238 0.478 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.797 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -63.58 107.14 0.68 Allowed 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.945 2.43 . . . . 0.0 112.11 -178.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 137.28 -27.39 2.88 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.863 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 52.8 m -102.37 -37.3 8.11 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.155 -0.618 . . . . 0.0 112.198 -176.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -177.12 -79.41 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 177.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.669 ' HB2' ' HD3' ' A' 3622 ' ' PRO . 0.3 OUTLIER -154.21 -66.85 0.02 OUTLIER Pre-proline 0 C--O 1.218 -0.593 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.108 173.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.669 ' HD3' ' HB2' ' A' 3621 ' ' GLN . 85.7 Cg_endo -102.66 27.78 0.1 Allowed 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 123.638 2.892 . . . . 0.0 112.942 -175.413 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3623 ' ' ALA . . . . . 0.567 ' HB3' ' HB ' ' A' 3664 ' ' VAL . . . -70.85 49.12 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -170.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.568 ' CD2' ' HB2' ' A' 3616 ' ' ASN . 19.5 m-85 -133.74 133.76 42.15 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 166.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.401 HG13 HD12 ' A' 3611 ' ' ILE . 10.7 t -117.76 114.12 44.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.555 177.777 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.603 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -99.36 111.19 23.6 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 169.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.54 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 40.5 mt-30 -93.85 111.76 23.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.928 -178.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.577 HG12 HG12 ' A' 3659 ' ' ILE . 42.1 mt -89.14 98.05 7.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.166 178.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -87.48 141.94 32.69 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.86 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.506 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 53.4 Cg_endo -69.3 172.96 11.27 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 122.656 2.237 . . . . 0.0 111.513 176.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.88 40.36 0.42 Allowed 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.801 2.334 . . . . 0.0 112.571 176.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.423 ' H ' ' C ' ' A' 3630 ' ' PRO . 22.6 p -72.05 161.63 30.62 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.852 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -51.2 -39.58 56.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.003 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 33.9 t80 -50.76 -53.88 28.03 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.04 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 5.6 m -62.72 -56.81 14.24 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.92 -177.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.45 -41.81 69.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.881 -175.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 21.3 m -67.46 -47.89 68.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.128 -176.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -64.24 -35.77 81.9 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.271 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.22 -34.16 77.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.962 176.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.655 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 37.7 m -67.02 -29.63 69.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.76 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.59 -56.45 3.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.166 176.309 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.592 HD12 HD21 ' A' 3575 ' ' LEU . 19.2 mt -66.04 -38.5 88.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.342 -171.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.403 ' CB ' HG12 ' A' 3527 ' ' VAL . . . -144.81 74.57 14.74 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.834 -0.166 . . . . 0.0 111.385 -178.183 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -67.76 -19.21 47.5 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.393 2.062 . . . . 0.0 111.74 -178.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3645 ' ' ASP . . . . . 0.567 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.5 m-20 -73.5 -51.58 16.6 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.004 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.716 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -77.85 -30.09 50.82 Favored 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -179.58 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.655 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -53.82 -47.34 70.97 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.33 177.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.55 -28.95 68.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.058 0.456 . . . . 0.0 111.148 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.567 ' HA ' ' HA ' ' A' 3496 ' ' VAL . 20.1 m -81.44 -33.34 32.16 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.041 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.54 ' HA ' HG21 ' A' 3653 ' ' ILE . 4.8 pt -83.95 -10.44 11.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.235 -178.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 38.4 m -55.36 -33.61 63.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.361 176.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -84.0 -33.01 24.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.647 179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.54 HG21 ' HA ' ' A' 3650 ' ' ILE . 9.5 tp -105.43 38.31 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 122.41 1.1 . . . . 0.0 109.335 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.488 ' N ' ' HD2' ' A' 3655 ' ' PRO . 22.9 t -39.27 -40.84 1.39 Allowed Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 113.996 -1.456 . . . . 0.0 113.606 173.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' 3654 ' ' SER . 17.6 Cg_endo -60.21 80.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 121.647 1.565 . . . . 0.0 111.597 168.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 21.7 p80 -146.72 177.14 9.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.687 -177.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.558 HD13 HD13 ' A' 3595 ' ' LEU . 39.1 mt -122.41 146.93 46.9 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.278 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 61.6 ttp -109.05 107.28 17.55 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 174.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.577 HG12 HG12 ' A' 3628 ' ' ILE . 81.2 mt -99.05 116.35 41.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.295 0.569 . . . . 0.0 111.218 -172.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.645 HG13 ' HD2' ' A' 3573 ' ' TYR . 94.0 t -103.07 113.91 41.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.993 -177.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.603 HG12 ' HG ' ' A' 3626 ' ' LEU . 62.7 mt -90.56 122.15 41.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.154 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -116.89 127.94 54.76 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.354 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 5.2 p -93.13 131.98 37.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.097 0.475 . . . . 0.0 110.868 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A 3664 ' ' VAL . . . . . 0.567 ' HB ' ' HB3' ' A' 3623 ' ' ALA . 30.6 t . . . . . 0 C--O 1.244 0.812 0 CA-C-O 118.785 -0.626 . . . . 0.0 110.021 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.593 ' CD1' ' HB2' ' A' 3553 ' ' MET . 24.5 m-85 . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 111.223 0.083 . . . . 0.0 111.223 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.484 ' CB ' ' HG2' ' A' 3552 ' ' ARG . 0.4 OUTLIER 54.96 -162.04 0.15 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.613 0.721 . . . . 0.0 111.704 177.589 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B 2520 ' ' THR . . . . . 0.465 ' HA ' ' HG2' ' A' 3551 ' ' GLN . 18.7 m -147.3 123.53 10.88 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 168.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.58 ' HG ' ' N ' ' B' 2522 ' ' SEP . 34.9 tp -81.39 -120.98 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.517 0 C-N-CA 119.54 -0.864 . . . . 0.0 109.956 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.635 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B 2523 ' ' ASP . . . . . 0.485 ' OD1' ' HD2' ' A' 3548 ' ' ARG . 14.7 t70 -158.07 -58.38 0.08 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.236 -1.347 . . . . 0.0 108.713 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 C--O 1.249 1.056 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.471 -177.964 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.408 HG22 ' HA ' ' A' 3649 ' ' SER . 14.3 m . . . . . 0 N--CA 1.479 1.01 0 CA-C-O 121.258 0.551 . . . . 0.0 110.786 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -106.3 144.93 32.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.929 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.616 ' HA ' ' CD2' ' A' 3501 ' ' LEU . 27.0 ptm -74.39 -19.09 60.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.195 0.521 . . . . 0.0 109.605 174.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.4 ' HA ' HD13 ' A' 3502 ' ' LEU . 47.6 t -60.32 -24.26 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.581 175.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -78.45 -59.14 2.9 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.273 175.035 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.616 ' CD2' ' HA ' ' A' 3498 ' ' MET . 2.9 pp -63.77 -35.74 81.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.455 -0.793 . . . . 0.0 113.007 -173.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.608 HD11 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.46 -15.73 62.85 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.683 -172.071 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.608 ' N ' HD11 ' A' 3502 ' ' LEU . 18.6 tptm -74.58 -16.3 60.81 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3504 ' ' LYS . . . . . 0.42 ' HA ' ' HD3' ' A' 3504 ' ' LYS . 44.3 mmtm -105.23 -43.11 5.09 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.818 173.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.722 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.68 102.48 3.45 Favored Pre-proline 0 N--CA 1.447 -0.614 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.24 -178.759 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -85.97 174.25 6.5 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 124.347 3.365 . . . . 0.0 113.602 -178.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.548 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 97.6 mt -71.98 137.18 24.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.938 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 29.6 m -104.24 -24.75 3.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.654 -178.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.602 ' HE3' HD11 ' A' 3524 ' ' LEU . 39.2 t90 -158.22 152.6 24.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.38 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3510 ' ' GLN . . . . . 0.434 ' HG3' ' HB3' ' A' 3523 ' ' GLN . 26.2 tt0 -148.2 119.94 8.08 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3511 ' ' GLY . . . . . 0.403 ' HA3' ' HA3' ' A' 3544 ' ' GLY . . . -166.54 -128.72 1.0 Allowed Glycine 0 N--CA 1.442 -0.948 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.66 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.0 mp -139.18 156.63 46.97 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.161 0.505 . . . . 0.0 111.101 178.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.463 HD23 ' HB2' ' A' 3547 ' ' LEU . 72.7 mt -109.48 151.67 26.41 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 169.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.764 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.76 124.04 13.0 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.698 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.607 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.08 142.9 38.14 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 171.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.607 ' HD3' HD12 ' A' 3515 ' ' LEU . 2.0 mptp? 63.79 -95.01 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -169.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 7.0 m120 -143.38 9.65 1.64 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.007 -0.997 . . . . 0.0 108.73 175.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.453 ' O ' ' HA ' ' A' 3514 ' ' ALA . 13.4 m-20 -94.89 128.75 41.89 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.164 -175.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.433 ' HA ' ' O ' ' A' 3513 ' ' LEU . 29.0 p -118.45 134.48 55.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.059 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -129.04 116.37 19.2 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.591 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.48 119.59 14.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.933 0.397 . . . . 0.0 109.955 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.433 ' HA ' ' O ' ' A' 3579 ' ' LEU . 28.0 m -128.08 147.55 32.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.664 0.745 . . . . 0.0 111.867 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3523 ' ' GLN . . . . . 0.434 ' HB3' ' HG3' ' A' 3510 ' ' GLN . 4.4 pt20 -112.29 125.17 53.88 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.599 -1.182 . . . . 0.0 108.58 173.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.613 HD21 HD13 ' A' 3576 ' ' LEU . 0.7 OUTLIER -96.89 112.34 24.14 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.278 0.561 . . . . 0.0 111.851 -174.773 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.548 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 73.5 m-70 -82.98 138.69 33.68 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.113 -0.948 . . . . 0.0 108.646 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.722 ' O ' ' HB2' ' A' 3505 ' ' TYR . 68.5 t80 -66.41 136.34 55.61 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 173.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.633 ' CG1' HD23 ' A' 3575 ' ' LEU . 18.9 t -115.2 -54.56 4.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 121.247 0.546 . . . . 0.0 110.931 177.152 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 28.7 t -159.1 170.42 22.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.124 -169.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.11 -147.11 20.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.23 174.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.536 ' HB2' ' HA ' ' A' 3571 ' ' THR . 41.9 t30 -107.6 108.97 20.48 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -63.17 -26.66 68.91 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.706 -175.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 47.4 t -59.27 -32.31 48.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.636 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.496 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 25.2 mt -57.8 -44.6 86.44 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.009 177.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -65.0 -42.19 94.69 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 120.765 0.317 . . . . 0.0 110.642 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -58.34 -41.57 84.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.695 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3536 ' ' ARG . . . . . 0.567 ' O ' ' HD2' ' A' 3617 ' ' PRO . 27.5 ptt180 -89.98 -4.95 57.17 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3537 ' ' SER . . . . . . . . . . . . . 13.3 p -104.43 -40.68 5.98 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.891 -0.506 . . . . 0.0 111.514 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.602 HD11 ' CB ' ' A' 3509 ' ' TRP . 22.9 mt -80.32 115.68 56.46 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-O 121.208 0.528 . . . . 0.0 110.874 -172.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3539 ' ' PRO . . . . . 0.43 ' HD3' HG22 ' A' 3614 ' ' VAL . 58.6 Cg_endo -78.26 150.96 26.13 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 123.03 2.487 . . . . 0.0 112.979 -176.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.485 ' HA ' ' CD ' ' A' 3545 ' ' PRO . 2.5 pp -151.69 170.54 19.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.95 177.76 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 21.5 p 175.14 -60.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.153 -176.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -96.94 -13.93 22.07 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.89 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 154.94 -61.45 0.37 Allowed Glycine 0 C--N 1.311 -0.85 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.536 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3544 ' ' GLY . . . . . 0.403 ' HA3' ' HA3' ' A' 3511 ' ' GLY . . . -164.84 88.48 0.1 Allowed Glycine 0 N--CA 1.442 -0.906 0 N-CA-C 111.68 -0.568 . . . . 0.0 111.68 174.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3545 ' ' PRO . . . . . 0.485 ' CD ' ' HA ' ' A' 3540 ' ' LEU . 31.8 Cg_exo -56.99 142.36 93.9 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.573 2.182 . . . . 0.0 111.328 178.138 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.66 ' HA ' ' O ' ' A' 3512 ' ' LEU . 56.4 Cg_endo -71.53 118.14 5.5 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.284 1.989 . . . . 0.0 112.76 -172.118 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.596 ' HB3' HD11 ' A' 3612 ' ' ILE . 37.1 mt -68.3 109.69 3.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.218 174.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.764 ' HA ' ' O ' ' A' 3514 ' ' ALA . 14.9 ptt180 -96.1 139.73 31.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.358 0.599 . . . . 0.0 111.48 -173.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.404 HD11 HD22 ' A' 3515 ' ' LEU . 19.8 mt -93.82 107.81 19.75 Favored 'Isoleucine or valine' 0 C--O 1.245 0.848 0 CA-C-O 122.037 0.922 . . . . 0.0 111.603 -172.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.471 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -116.85 5.37 13.0 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.363 -175.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.695 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 42.3 mt-30 -149.4 165.82 30.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.391 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.689 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -155.09 138.31 15.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 0.0 110.923 -179.783 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.548 ' HG3' ' CE2' ' B' 2518 ' ' TYR . 13.7 tmm? -111.25 121.54 45.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.5 177.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -63.01 109.88 1.62 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.623 HD11 ' O ' ' A' 3555 ' ' LEU . 3.4 pp -70.06 99.16 1.41 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 122.5 1.143 . . . . 0.0 109.703 -177.203 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.438 ' O ' ' HG ' ' A' 3560 ' ' LEU . 8.4 mm-40 -104.91 152.39 22.71 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.291 178.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.565 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -53.25 -48.23 68.4 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 175.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 22.2 m -58.08 -43.84 87.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.597 176.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.527 ' O ' HG21 ' A' 3563 ' ' VAL . 12.1 mm100 -66.06 -45.7 80.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.999 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' 3556 ' ' GLU . 94.0 mt -62.88 -36.38 83.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.447 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' 3557 ' ' ALA . 8.7 mm-40 -56.19 -51.19 68.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.39 172.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -60.9 -41.73 99.4 Favored Glycine 0 CA--C 1.521 0.431 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.548 178.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.527 HG21 ' O ' ' A' 3559 ' ' GLN . 63.1 t -62.6 -48.88 86.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.882 0.372 . . . . 0.0 110.456 177.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.78 -30.92 69.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.71 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.5 ' O ' ' HB ' ' A' 3568 ' ' THR . 34.5 ttm180 -60.53 -40.65 92.26 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.741 0.305 . . . . 0.0 111.192 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -86.6 -10.01 54.84 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.335 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.519 ' HE2' HD13 ' A' 3575 ' ' LEU . 83.1 mtp -83.25 -20.51 34.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.961 0.886 . . . . 0.0 108.969 171.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3568 ' ' THR . . . . . 0.5 ' HB ' ' O ' ' A' 3565 ' ' ARG . 23.2 m -75.5 -15.54 60.39 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 114.174 -1.376 . . . . 0.0 110.26 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 47.7 t -116.45 90.09 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.987 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.39 108.26 4.17 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.536 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 153.26 -45.48 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 O-C-N 125.057 1.473 . . . . 0.0 107.98 -174.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.08 -30.71 58.42 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.602 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.756 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -126.76 165.79 18.62 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.392 179.269 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.594 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 51.2 t -127.42 134.53 49.88 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 171.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.633 HD23 ' CG1' ' A' 3527 ' ' VAL . 15.2 tp -105.56 126.91 52.68 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.613 HD13 HD21 ' A' 3524 ' ' LEU . 76.9 mt -125.9 154.51 42.65 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.149 0.5 . . . . 0.0 110.934 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.731 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -121.55 108.33 13.48 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.074 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.468 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 123.33 37.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.365 0.602 . . . . 0.0 110.748 -177.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' 3522 ' ' VAL . 85.5 mt -123.35 143.59 41.64 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.943 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -61.8 110.99 1.07 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.341 2.028 . . . . 0.0 112.038 178.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.4 p -95.97 114.33 26.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.337 0.589 . . . . 0.0 110.532 -178.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.93 145.9 16.22 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.542 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 34.1 ttp180 -60.19 -47.69 84.88 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 123.728 0.811 . . . . 0.0 110.73 175.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.536 ' O ' HG21 ' A' 3588 ' ' VAL . 2.2 p30 -134.92 179.78 6.1 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.3 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -54.98 -46.65 75.12 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.246 0.341 . . . . 0.0 111.57 -175.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -67.31 -40.82 86.05 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 19.5 t70 -60.61 -42.53 97.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.289 179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.536 HG21 ' O ' ' A' 3584 ' ' ASP . 81.1 t -57.46 -49.26 80.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.368 176.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3589 ' ' VAL . . . . . 0.435 ' O ' ' HG2' ' A' 3593 ' ' GLU . 93.7 t -59.66 -49.37 83.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.369 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 29.7 t -59.43 -43.2 93.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.24 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -68.9 -36.09 77.62 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.841 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 88.5 m -63.01 -54.29 40.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.857 0.36 . . . . 0.0 110.78 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3593 ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.9 pt-20 -62.88 -34.68 77.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.32 -178.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 50.6 m -70.22 -42.09 72.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.647 0.261 . . . . 0.0 110.721 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.578 HD13 HD11 ' A' 3657 ' ' LEU . 58.8 tp -63.15 -45.48 91.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.999 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.812 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 21.2 ptmt -67.51 -29.82 69.33 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.657 -0.417 . . . . 0.0 111.161 -178.023 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -80.97 -40.78 23.87 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.745 0.307 . . . . 0.0 111.656 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -90.71 -46.54 8.19 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -171.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.482 ' HB2' HD11 ' A' 3595 ' ' LEU . 9.5 m-85 -98.34 -50.01 4.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.719 0.295 . . . . 0.0 111.323 -174.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.812 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 25.6 mm -60.66 -55.03 27.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.721 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 73.3 m -56.27 -39.79 73.18 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 123.295 0.372 . . . . 0.0 110.977 179.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.818 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.1 OUTLIER -66.68 -57.65 6.73 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.063 179.008 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.818 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.93 -41.25 77.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 -177.704 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3604 ' ' GLN . . . . . 0.415 HE21 ' HB2' ' A' 3604 ' ' GLN . 0.0 OUTLIER -72.9 -37.1 67.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.698 -177.127 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.16 -33.88 72.32 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.973 0.416 . . . . 0.0 110.848 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -81.16 -19.04 44.26 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.837 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3607 ' ' GLN . . . . . 0.443 ' O ' ' HG ' ' A' 3555 ' ' LEU . 89.8 mt-30 46.31 61.32 2.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.376 0.608 . . . . 0.0 109.582 -168.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.429 ' O ' HD13 ' A' 3603 ' ' LEU . . . -137.84 -177.68 4.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.588 -173.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.689 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -118.19 117.89 30.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.212 173.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.02 101.14 0.45 Allowed Glycine 0 C--O 1.223 -0.571 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.695 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 31.4 mm -89.4 127.7 41.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 121.264 0.554 . . . . 0.0 110.977 -173.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.596 HD11 ' HB3' ' A' 3547 ' ' LEU . 71.5 mt -128.7 105.1 12.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.025 -0.989 . . . . 0.0 109.961 177.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.574 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.6 m120 -81.0 116.84 21.16 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 172.574 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.43 HG22 ' HD3' ' A' 3539 ' ' PRO . 8.0 p -120.13 135.04 24.12 Favored Pre-proline 0 C--N 1.309 -1.16 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.42 -176.229 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3615 ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.28 134.55 14.28 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.888 1.725 . . . . 0.0 111.612 174.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.533 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 0.2 OUTLIER -58.78 114.66 9.45 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.615 178.759 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3617 ' ' PRO . . . . . 0.567 ' HD2' ' O ' ' A' 3536 ' ' ARG . 6.0 Cg_endo -48.9 109.53 0.27 Allowed 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.2 2.6 . . . . 0.0 112.417 -178.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 102.18 -35.77 4.72 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.363 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3619 ' ' SER . . . . . 0.53 ' HB2' ' HB3' ' A' 3616 ' ' ASN . 7.6 m -96.02 -18.42 20.24 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.78 0.324 . . . . 0.0 110.967 -177.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3620 ' ' ASN . . . . . 0.409 ' O ' ' HD3' ' A' 3622 ' ' PRO . 5.4 t30 64.59 16.38 10.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.275 0.63 . . . . 0.0 111.522 176.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.419 ' HA ' ' HD3' ' A' 3622 ' ' PRO . 26.1 mt-30 -81.79 108.27 10.67 Favored Pre-proline 0 C--N 1.327 -0.403 0 O-C-N 122.326 -0.234 . . . . 0.0 110.404 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' 3621 ' ' GLN . 19.7 Cg_endo -89.23 17.19 1.66 Allowed 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 123.121 2.548 . . . . 0.0 112.333 -177.209 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -81.98 41.57 0.67 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.009 -177.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.574 ' O ' ' HA ' ' A' 3613 ' ' ASN . 92.3 m-85 -127.88 132.39 49.36 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.833 178.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.409 HG13 HG22 ' A' 3611 ' ' ILE . 3.3 t -120.51 113.66 40.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.766 176.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.604 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.3 mp -94.98 112.25 23.97 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 171.518 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.455 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 36.8 mt-30 -93.99 110.71 22.38 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.299 -178.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.573 HG12 HG12 ' A' 3659 ' ' ILE . 48.0 mt -90.3 97.86 7.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.954 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -89.13 143.13 30.68 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.823 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.523 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 48.5 Cg_endo -69.12 169.26 18.5 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.305 2.004 . . . . 0.0 111.039 175.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -68.64 55.16 0.85 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.115 2.544 . . . . 0.0 112.433 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.431 ' O ' ' HG2' ' A' 3636 ' ' GLU . 8.5 p -83.22 162.32 21.25 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.748 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.06 -42.3 76.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.355 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 19.9 t80 -60.41 -40.05 89.62 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.864 0.364 . . . . 0.0 110.272 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 12.4 t -61.33 -59.1 5.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.637 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3636 ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' 3632 ' ' CYS . 7.9 mm-40 -65.19 -34.0 77.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.297 -173.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 30.6 t -65.25 -48.72 72.29 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.908 0.385 . . . . 0.0 110.264 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -67.21 -32.02 72.8 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.353 178.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3639 ' ' LEU . . . . . 0.459 ' HB3' HD23 ' A' 3647 ' ' LEU . 65.0 mt -63.16 -40.32 97.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.899 175.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.613 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 38.0 m -63.83 -31.82 73.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.362 0.601 . . . . 0.0 110.153 178.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -80.11 -45.97 17.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.014 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.591 HD12 HD22 ' A' 3575 ' ' LEU . 19.5 mt -82.37 -35.0 28.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.564 -0.744 . . . . 0.0 112.449 -172.004 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.455 ' HB2' ' CZ ' ' A' 3505 ' ' TYR . . . -147.86 82.57 7.83 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.86 0.362 . . . . 0.0 111.124 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.23 -26.9 48.92 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.804 2.336 . . . . 0.0 113.377 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 8.0 t70 -75.34 -52.12 11.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.096 0.474 . . . . 0.0 110.197 -173.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.731 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -71.14 -29.31 65.07 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.598 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.613 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -55.26 -52.24 64.03 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.811 0.338 . . . . 0.0 110.622 178.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.79 -28.61 68.88 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.042 0.449 . . . . 0.0 110.682 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.408 ' HA ' HG22 ' A' 3496 ' ' VAL . 20.3 m -76.79 -35.19 57.8 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.114 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.498 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.4 pt -83.07 -9.92 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.413 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.5 m -63.85 -16.38 61.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.214 0.53 . . . . 0.0 110.114 175.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 47.4 t30 -87.94 -38.72 15.34 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.904 173.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.51 ' O ' HG13 ' A' 3653 ' ' ILE . 7.7 tp -105.25 41.08 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 122.527 1.156 . . . . 0.0 109.66 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.475 ' N ' ' HD2' ' A' 3655 ' ' PRO . 14.7 m -38.05 -43.06 1.52 Allowed Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 114.008 -1.451 . . . . 0.0 113.747 172.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' 3654 ' ' SER . 19.6 Cg_endo -61.27 77.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 121.631 1.554 . . . . 0.0 111.818 169.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 25.9 p80 -142.82 174.61 10.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.981 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.578 HD11 HD13 ' A' 3595 ' ' LEU . 36.9 mt -120.63 142.05 49.79 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.301 178.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 13.3 tmm? -105.84 109.64 21.66 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.573 HG12 HG12 ' A' 3628 ' ' ILE . 74.6 mt -105.38 119.05 53.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.264 0.554 . . . . 0.0 111.499 -171.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.756 HG13 ' HD2' ' A' 3573 ' ' TYR . 81.0 t -102.68 116.6 46.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.686 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.604 HG12 ' HG ' ' A' 3626 ' ' LEU . 54.3 mt -90.53 111.86 24.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.49 128.14 56.34 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 120.97 0.414 . . . . 0.0 111.503 -177.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 8.5 m -74.06 142.11 45.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.714 171.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 84.1 t . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.418 -0.801 . . . . 0.0 109.612 175.452 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.548 ' CE2' ' HG3' ' A' 3553 ' ' MET . 1.5 m-85 . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 120.538 0.208 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.64 ' O ' ' HG2' ' A' 3551 ' ' GLN . 48.4 tt0 59.29 -175.6 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -177.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 6.2 p -140.59 123.83 16.71 Favored 'General case' 0 C--N 1.317 -0.831 0 O-C-N 121.795 -0.566 . . . . 0.0 110.211 178.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.649 ' HG ' ' N ' ' B' 2522 ' ' SEP . 20.7 tp -88.82 -130.37 0.08 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.245 177.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.649 ' N ' ' HG ' ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 18.3 t70 -155.84 -73.28 0.11 Allowed 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 . . . . . 0 C--O 1.247 0.969 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.522 -174.089 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.69 ' HA ' ' HA ' ' A' 3649 ' ' SER . 10.2 p . . . . . 0 N--CA 1.481 1.111 0 CA-C-O 121.789 0.804 . . . . 0.0 110.837 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3497 ' ' ASP . . . . . 0.448 ' OD2' ' HB ' ' A' 3499 ' ' VAL . 25.7 t70 -107.13 126.56 52.54 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.928 -176.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.502 ' HE2' ' HE1' ' A' 3525 ' ' HIS . 77.8 mtp -74.49 -27.99 60.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.345 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.491 ' HA ' HD11 ' A' 3502 ' ' LEU . 27.4 t -66.92 -24.8 33.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.42 0.629 . . . . 0.0 110.447 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -72.86 -58.93 2.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.096 174.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.593 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.2 pp -69.94 -33.01 71.57 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -168.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.607 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.85 -15.46 62.64 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 120.049 -0.661 . . . . 0.0 110.023 -174.258 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.607 ' N ' HD12 ' A' 3502 ' ' LEU . 26.8 tptp -66.77 -33.53 75.83 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.882 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 22.0 mttp -98.73 -43.72 6.68 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.141 0.496 . . . . 0.0 110.849 178.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.732 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -143.75 97.01 5.49 Favored Pre-proline 0 N--CA 1.441 -0.891 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.379 -176.489 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -81.85 174.17 10.51 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 124.045 3.163 . . . . 0.0 113.533 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.455 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 74.3 mt -71.33 135.79 27.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.647 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 32.8 m -109.04 -24.39 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.927 -176.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.658 ' HE3' HD12 ' A' 3524 ' ' LEU . 34.6 t90 -151.3 153.72 35.37 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.673 0.273 . . . . 0.0 110.362 -176.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -150.92 119.76 6.61 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -176.32 -134.02 1.88 Allowed Glycine 0 N--CA 1.445 -0.751 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.596 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -136.32 154.45 50.86 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.194 0.521 . . . . 0.0 111.334 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.454 HD22 ' HB2' ' A' 3547 ' ' LEU . 78.1 mt -107.45 152.76 23.78 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 170.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.684 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -148.29 123.64 10.29 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -177.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.577 HD13 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.81 143.46 38.91 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 173.117 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.577 ' HD3' HD13 ' A' 3515 ' ' LEU . 0.4 OUTLIER 62.87 -94.97 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 -169.294 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -142.91 10.44 1.77 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 173.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.496 ' O ' ' HA ' ' A' 3514 ' ' ALA . 62.2 m-20 -91.88 128.31 37.68 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.55 -174.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 11.9 p -119.13 137.74 53.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.337 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -137.26 118.69 14.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.458 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.596 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.96 124.84 26.25 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 177.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.405 ' HA ' ' O ' ' A' 3579 ' ' LEU . 29.5 m -134.4 147.61 29.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.609 0.718 . . . . 0.0 111.862 -175.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3523 ' ' GLN . . . . . 0.535 ' HG2' ' HB3' ' A' 3581 ' ' CYS . 9.1 pt20 -111.47 125.61 54.08 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.023 -0.99 . . . . 0.0 108.709 171.291 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.658 HD12 ' HE3' ' A' 3509 ' ' TRP . 2.2 mt -93.29 111.68 23.39 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.86 -175.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.502 ' HE1' ' HE2' ' A' 3498 ' ' MET . 68.2 m-70 -85.05 138.01 32.7 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.209 -0.905 . . . . 0.0 108.897 174.014 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.732 ' O ' ' HB2' ' A' 3505 ' ' TYR . 66.0 t80 -67.59 141.15 56.89 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 173.252 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.635 ' CG1' HD21 ' A' 3575 ' ' LEU . 23.9 t -115.7 -54.91 4.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 121.387 0.613 . . . . 0.0 110.764 174.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.462 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 68.5 m -160.69 172.01 17.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.786 -171.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3529 ' ' GLY . . . . . 0.457 ' HA2' ' HB3' ' A' 3570 ' ' GLU . . . 89.33 -151.11 21.75 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.298 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.511 ' HB2' ' HA ' ' A' 3571 ' ' THR . 39.7 t30 -108.26 117.6 34.58 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.597 0.237 . . . . 0.0 110.5 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.2 p30 -62.69 -29.14 70.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.4 -176.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3532 ' ' VAL . . . . . 0.431 ' HB ' HD22 ' A' 3530 ' ' ASN . 60.2 t -57.93 -34.75 49.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.37 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3533 ' ' LEU . . . . . . . . . . . . . 34.2 mt -59.11 -46.22 88.88 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.462 ' HA ' HD11 ' A' 3661 ' ' ILE . . . -66.36 -41.34 89.63 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 120.84 0.352 . . . . 0.0 110.474 -177.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -60.43 -39.18 86.51 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.356 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -89.01 -17.74 28.78 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.485 ' HB2' HD12 ' A' 3626 ' ' LEU . 51.0 p -93.28 -41.61 9.78 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.966 -0.459 . . . . 0.0 110.788 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' 3509 ' ' TRP . 21.4 mt -80.56 110.39 16.78 Favored Pre-proline 0 C--N 1.32 -0.677 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 -179.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.83 139.23 15.42 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.554 2.169 . . . . 0.0 112.369 -176.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.472 ' CD1' ' HA3' ' A' 3544 ' ' GLY . 29.2 mt 48.17 -154.17 0.08 Allowed 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.742 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 67.3 m -159.76 -39.68 0.05 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.509 -1.223 . . . . 0.0 109.017 165.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -130.4 154.42 47.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.455 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 66.32 37.17 92.6 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.228 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3544 ' ' GLY . . . . . 0.472 ' HA3' ' CD1' ' A' 3540 ' ' LEU . . . -157.63 -178.03 31.3 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.68 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3545 ' ' PRO . . . . . 0.41 ' HA ' ' HD3' ' A' 3546 ' ' PRO . 72.1 Cg_endo -76.38 139.99 21.37 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.939 2.426 . . . . 0.0 113.011 -178.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 21.5 Cg_exo -67.36 158.31 57.63 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.909 2.406 . . . . 0.0 111.616 173.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.611 ' HB3' HD13 ' A' 3612 ' ' ILE . 19.7 mt -69.04 109.23 3.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.263 177.52 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.684 ' HA ' ' O ' ' A' 3514 ' ' ALA . 18.5 ptt180 -90.98 144.49 25.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.81 0.338 . . . . 0.0 110.902 -178.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3549 ' ' ILE . . . . . . . . . . . . . 19.6 mt -99.19 110.93 27.48 Favored 'Isoleucine or valine' 0 C--O 1.246 0.874 0 CA-C-O 121.848 0.832 . . . . 0.0 111.12 -178.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.61 ' CB ' ' HA ' ' B' 2525 ' ' GLU . . . -117.42 5.92 12.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.281 -174.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.663 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 58.9 mt-30 -152.89 170.26 20.79 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.386 0.136 . . . . 0.0 110.935 177.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.713 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -153.18 139.29 18.3 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.744 0.307 . . . . 0.0 111.528 -177.609 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.602 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.7 tmm? -116.88 111.65 19.96 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.839 176.082 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 75.9 mtm-85 -61.07 111.03 1.53 Allowed 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.417 HD11 ' O ' ' A' 3555 ' ' LEU . 1.8 pp -68.53 98.34 0.86 Allowed 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.071 0.939 . . . . 0.0 109.545 -176.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.593 ' O ' ' HG ' ' A' 3560 ' ' LEU . 13.0 mm-40 -109.62 164.35 12.61 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.643 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -53.34 -51.39 62.57 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.884 0.373 . . . . 0.0 111.447 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 21.0 p -65.42 -36.56 84.29 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.982 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.487 ' O ' HG21 ' A' 3563 ' ' VAL . 16.0 mm100 -64.91 -37.83 88.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.753 178.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' 3556 ' ' GLU . 86.4 mt -64.85 -31.33 72.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.648 179.259 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -67.12 -44.25 80.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.206 0.527 . . . . 0.0 110.098 173.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -56.16 -45.46 87.72 Favored Glycine 0 CA--C 1.518 0.225 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.819 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.557 ' O ' ' HG2' ' A' 3566 ' ' ARG . 60.0 t -62.55 -43.63 98.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 0.0 110.342 176.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -56.8 -39.87 74.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.26 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.6 ' O ' ' HB ' ' A' 3568 ' ' THR . 45.8 ttt180 -58.33 -44.11 88.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.678 0.275 . . . . 0.0 111.469 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3566 ' ' ARG . . . . . 0.557 ' HG2' ' O ' ' A' 3563 ' ' VAL . 5.7 ptp180 -76.69 -20.07 57.0 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.49 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.564 ' HG2' ' CE2' ' A' 3573 ' ' TYR . 81.3 mtp -84.61 -11.74 55.37 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.319 0.581 . . . . 0.0 109.964 175.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3568 ' ' THR . . . . . 0.6 ' HB ' ' O ' ' A' 3565 ' ' ARG . 3.3 m -74.8 -23.93 58.57 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.171 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 60.6 t -126.58 101.27 7.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.257 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3570 ' ' GLU . . . . . 0.457 ' HB3' ' HA2' ' A' 3529 ' ' GLY . 44.9 mt-10 -75.72 109.0 8.95 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.511 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.2 m 148.55 -38.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.646 1.578 . . . . 0.0 107.287 -172.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.85 -27.53 40.12 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.238 176.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.734 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.1 OUTLIER -131.36 164.0 26.63 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.064 176.237 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.6 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 47.7 t -127.74 135.43 50.13 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 171.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.635 HD21 ' CG1' ' A' 3527 ' ' VAL . 13.6 tp -104.67 125.66 51.0 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.521 HD11 HD23 ' A' 3524 ' ' LEU . 64.5 mt -126.18 158.2 36.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.245 0.545 . . . . 0.0 111.217 -176.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.524 ' HG ' HD13 ' A' 3646 ' ' LEU . 0.3 OUTLIER -126.13 107.93 10.86 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.699 178.79 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.485 ' HB2' HD11 ' A' 3659 ' ' ILE . . . -94.83 123.04 38.06 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.251 0.548 . . . . 0.0 110.626 -177.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.405 ' O ' ' HA ' ' A' 3522 ' ' VAL . 83.4 mt -123.02 142.56 38.48 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.299 -179.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -61.87 112.11 1.4 Allowed 'Trans proline' 0 C--O 1.234 0.312 0 C-N-CA 122.382 2.055 . . . . 0.0 111.835 178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3581 ' ' CYS . . . . . 0.535 ' HB3' ' HG2' ' A' 3523 ' ' GLN . 28.9 p -98.7 120.25 38.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.005 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3582 ' ' GLY . . . . . 0.47 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -97.52 142.69 16.29 Favored Glycine 0 N--CA 1.439 -1.111 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.536 -178.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 45.2 mtt85 -66.32 -31.42 72.2 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.037 0.922 . . . . 0.0 109.041 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.563 ' O ' HG23 ' A' 3588 ' ' VAL . 28.7 t70 -144.93 170.04 16.91 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.062 -1.426 . . . . 0.0 107.739 176.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -56.5 -38.11 71.31 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 118.203 0.456 . . . . 0.0 110.347 177.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -61.05 -46.72 89.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.383 0.611 . . . . 0.0 109.765 176.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.58 ' O ' ' HG2' ' A' 3591 ' ' GLN . 6.2 t70 -60.5 -44.75 95.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.173 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' 3584 ' ' ASP . 86.9 t -52.18 -41.37 33.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.104 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3589 ' ' VAL . . . . . 0.439 ' O ' ' HG2' ' A' 3593 ' ' GLU . 3.6 t -63.82 -52.32 58.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.685 0.755 . . . . 0.0 109.399 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 71.6 m -58.22 -43.83 87.91 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.116 -1.402 . . . . 0.0 111.977 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3591 ' ' GLN . . . . . 0.58 ' HG2' ' O ' ' A' 3587 ' ' ASP . 18.1 mm-40 -68.61 -41.31 79.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.038 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 83.2 m -61.45 -52.42 64.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.095 -178.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3593 ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.1 pt-20 -67.23 -32.75 74.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.288 -178.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 28.1 t -64.78 -46.38 82.35 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 176.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.578 HD11 HD11 ' A' 3657 ' ' LEU . 52.0 tp -63.76 -46.2 86.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.231 -178.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.78 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.7 -29.26 69.78 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.493 -175.973 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 3597 ' ' ALA . . . . . 0.455 ' O ' ' HB ' ' A' 3601 ' ' THR . . . -85.91 -42.38 14.13 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.908 0.385 . . . . 0.0 111.256 179.132 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -85.24 -45.85 11.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -170.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.489 ' HB2' HD12 ' A' 3595 ' ' LEU . 15.1 m-85 -99.34 -50.41 4.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.704 0.288 . . . . 0.0 111.18 -176.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.78 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 26.3 mm -61.38 -55.78 22.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.066 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3601 ' ' THR . . . . . 0.455 ' HB ' ' O ' ' A' 3597 ' ' ALA . 74.4 m -60.43 -38.27 83.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.687 0.28 . . . . 0.0 111.221 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.817 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.0 OUTLIER -67.05 -55.84 12.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.687 178.336 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.817 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.82 -41.98 78.8 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -178.354 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -70.74 -37.81 73.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.594 -177.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.13 -38.53 82.3 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 121.085 0.469 . . . . 0.0 110.626 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3606 ' ' LYS . . . . . 0.415 ' HG2' ' O ' ' A' 3602 ' ' TYR . 69.6 mmtt -77.5 -19.43 55.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.482 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 49.9 49.94 19.34 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.625 -169.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.431 ' O ' HD11 ' A' 3603 ' ' LEU . . . -128.5 -175.48 3.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.362 0.601 . . . . 0.0 112.169 -171.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.713 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.67 117.82 29.28 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.239 175.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.02 102.55 0.59 Allowed Glycine 0 C--O 1.221 -0.666 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 176.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.663 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.3 mm -89.21 121.4 39.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 121.204 0.526 . . . . 0.0 110.84 -174.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.611 HD13 ' HB3' ' A' 3547 ' ' LEU . 57.6 mt -117.87 105.38 17.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.444 175.139 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -87.41 115.32 24.74 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.867 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 3.3 p -119.63 126.98 26.67 Favored Pre-proline 0 C--N 1.314 -0.939 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.583 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.523 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 47.4 Cg_endo -70.35 138.73 36.6 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.296 1.997 . . . . 0.0 111.95 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.702 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 53.1 t30 -63.08 116.34 24.07 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.407 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3617 ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' 3616 ' ' ASN . 10.5 Cg_endo -54.01 108.86 0.31 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.152 2.568 . . . . 0.0 112.33 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 115.09 -32.25 5.87 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.1 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 15.6 m -106.6 -22.21 12.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.754 0.311 . . . . 0.0 110.907 -179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 12.2 t-20 66.76 11.61 8.34 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.336 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3621 ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -80.62 116.8 64.53 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.523 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 88.0 Cg_endo -77.3 25.87 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 123.598 2.865 . . . . 0.0 113.033 -176.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -73.87 27.4 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -174.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.702 ' HE2' ' HB2' ' A' 3616 ' ' ASN . 85.5 m-85 -123.15 132.16 53.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.134 0.492 . . . . 0.0 110.58 178.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 4.2 t -124.84 117.27 49.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.003 178.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.618 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -98.17 112.25 24.29 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 170.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.479 ' HB3' ' HB1' ' A' 3609 ' ' ALA . 34.0 mt-30 -94.72 110.47 22.31 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.658 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.578 HG12 HG12 ' A' 3659 ' ' ILE . 38.7 mt -92.14 98.06 7.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.027 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3629 ' ' PHE . . . . . 0.527 ' HB2' ' HE2' ' A' 3658 ' ' MET . 97.5 m-85 -89.78 147.67 38.11 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.764 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.447 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.8 Cg_endo -70.35 171.02 15.91 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.364 2.043 . . . . 0.0 111.134 175.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.37 42.04 0.45 Allowed 'Trans proline' 0 CA--C 1.532 0.425 0 C-N-CA 123.025 2.483 . . . . 0.0 112.603 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.414 ' H ' ' C ' ' A' 3630 ' ' PRO . 24.8 p -72.56 163.36 28.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.151 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -44.95 -47.97 11.37 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 123.721 0.638 . . . . 0.0 110.937 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 26.6 t80 -48.95 -55.43 11.88 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.653 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3635 ' ' SER . . . . . 0.47 ' HA ' ' HE1' ' A' 3658 ' ' MET . 19.7 m -56.58 -58.09 9.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.979 -177.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -60.81 -35.43 76.49 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.388 -174.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 66.4 m -57.34 -61.99 2.09 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.072 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -69.83 -20.36 63.44 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.143 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 62.8 mt -66.03 -35.97 81.99 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.364 174.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.788 ' HA ' HD22 ' A' 3647 ' ' LEU . 15.3 m -69.6 -35.31 75.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.321 0.581 . . . . 0.0 110.467 178.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -81.14 -37.79 28.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.058 -178.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.588 HD13 HD23 ' A' 3575 ' ' LEU . 15.7 mt -89.37 -31.11 17.93 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -174.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.42 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -153.0 72.53 7.11 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -176.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3644 ' ' PRO . . . . . 0.543 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 50.3 Cg_endo -70.87 -17.17 32.73 Favored 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 122.152 1.901 . . . . 0.0 111.856 177.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3645 ' ' ASP . . . . . 0.535 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 40.1 m-20 -72.73 -45.0 60.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.177 -177.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.593 ' HB2' HD13 ' A' 3501 ' ' LEU . 0.1 OUTLIER -83.09 -28.79 29.24 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 176.634 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.788 HD22 ' HA ' ' A' 3640 ' ' SER . 22.4 tp -50.54 -47.05 57.8 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.546 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.15 -19.01 61.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.945 0.402 . . . . 0.0 111.705 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.69 ' HA ' ' HA ' ' A' 3496 ' ' VAL . 36.6 m -89.69 -31.05 17.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.839 0.352 . . . . 0.0 110.824 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.527 HG12 ' HA ' ' A' 3647 ' ' LEU . 6.5 pt -85.83 -13.77 10.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.623 -178.21 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 47.4 m -59.48 -22.17 61.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.795 0.331 . . . . 0.0 111.222 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -88.02 -38.37 15.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.481 0.658 . . . . 0.0 109.758 174.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.548 HD13 ' HG2' ' A' 3655 ' ' PRO . 8.2 tp -105.26 42.4 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 122.288 1.042 . . . . 0.0 109.408 -178.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.482 ' N ' ' HD2' ' A' 3655 ' ' PRO . 42.0 m -40.37 -42.0 2.86 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 114.384 -1.28 . . . . 0.0 113.148 171.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.548 ' HG2' HD13 ' A' 3653 ' ' ILE . 11.2 Cg_endo -58.15 83.45 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.635 1.557 . . . . 0.0 111.404 167.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.0 p-80 -149.26 169.71 20.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.253 -177.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.578 HD11 HD11 ' A' 3595 ' ' LEU . 46.3 mt -117.57 132.83 56.46 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.581 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3658 ' ' MET . . . . . 0.527 ' HE2' ' HB2' ' A' 3629 ' ' PHE . 9.5 tmm? -99.61 109.82 22.3 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 177.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.583 HD11 HD22 ' A' 3524 ' ' LEU . 74.2 mt -107.31 121.48 60.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 121.281 0.562 . . . . 0.0 111.566 -170.152 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.734 HG12 ' HD2' ' A' 3573 ' ' TYR . 91.8 t -104.56 113.8 42.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.727 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.618 HG12 ' HG ' ' A' 3626 ' ' LEU . 58.3 mt -91.02 115.53 30.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.829 177.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -124.47 132.51 53.49 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.834 -0.346 . . . . 0.0 111.622 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 24.7 m -86.03 112.44 21.24 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 171.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.533 -178.65 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.602 ' CD1' ' HB2' ' A' 3553 ' ' MET . 57.0 m-85 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.539 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.6 OUTLIER 56.13 -162.02 0.18 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.829 0.823 . . . . 0.0 111.848 176.69 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 25.7 m -146.32 117.88 8.02 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 114.613 -1.176 . . . . 0.0 108.032 168.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.562 ' HG ' ' N ' ' B' 2522 ' ' SEP . 24.4 tp -80.04 -130.15 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.042 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.562 ' N ' ' HG ' ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 12.4 t70 -177.77 -74.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.027 -1.442 . . . . 0.0 107.64 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2524 ' ' SEP . . . . . 0.451 ' O ' ' HB2' ' B' 2525 ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B 2525 ' ' GLU . . . . . 0.61 ' HA ' ' CB ' ' A' 3550 ' ' ALA . 29.9 tt0 . . . . . 0 C--O 1.245 0.821 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.197 174.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3496 ' ' VAL . . . . . . . . . . . . . 21.8 m . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 121.073 0.463 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -102.56 115.18 30.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.988 -175.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 4.2 mpp? -75.1 -10.9 59.9 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.306 0.574 . . . . 0.0 109.817 178.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 25.9 t -61.66 -21.56 25.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.889 176.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -83.3 -58.97 2.61 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.848 0.356 . . . . 0.0 110.898 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.571 HD11 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp -60.27 -32.29 71.03 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -172.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.581 HD11 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.37 -15.56 63.75 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.546 -174.065 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.581 ' N ' HD11 ' A' 3502 ' ' LEU . 13.7 mptt -57.41 -42.64 82.69 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.212 173.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3504 ' ' LYS . . . . . 0.476 ' HB3' ' CD2' ' A' 3505 ' ' TYR . 5.1 tmtm? -95.45 -38.6 10.39 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.731 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -147.06 101.39 3.87 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-O 121.302 0.572 . . . . 0.0 111.629 -177.422 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3506 ' ' PRO . . . . . 0.47 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 91.9 Cg_endo -86.23 174.02 6.38 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 124.158 3.239 . . . . 0.0 113.723 -178.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.473 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 88.2 mt -71.88 131.34 34.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.243 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 29.3 m -100.96 -28.82 3.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.466 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.674 ' HE3' HD13 ' A' 3524 ' ' LEU . 14.0 t90 -153.11 155.05 36.05 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 110.229 -0.285 . . . . 0.0 110.229 -175.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -150.95 119.93 6.67 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.74 -130.52 1.23 Allowed Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 -178.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.609 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -136.87 152.71 50.54 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.359 0.6 . . . . 0.0 111.437 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.464 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 72.6 mt -105.53 153.61 21.51 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 168.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.648 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -146.64 124.07 11.67 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -177.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.826 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.3 144.61 38.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.687 172.674 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.826 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.7 OUTLIER 59.36 -93.56 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 122.964 0.506 . . . . 0.0 110.293 -170.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 20.2 m120 -141.78 7.31 1.86 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.842 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -104.51 129.67 52.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.115 0.484 . . . . 0.0 111.205 -177.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.553 HG21 ' HB1' ' A' 3514 ' ' ALA . 18.0 p -108.96 154.81 21.64 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.509 176.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -143.97 113.49 7.03 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.776 175.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.609 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.52 115.87 10.2 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.115 0.483 . . . . 0.0 110.059 177.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 28.0 m -129.67 147.77 33.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.582 0.706 . . . . 0.0 111.795 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3523 ' ' GLN . . . . . 0.438 ' HG2' ' HB3' ' A' 3581 ' ' CYS . 3.8 pt20 -108.59 125.73 52.16 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.021 -0.99 . . . . 0.0 108.861 172.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.674 HD13 ' HE3' ' A' 3509 ' ' TRP . 0.9 OUTLIER -93.07 111.37 22.98 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.421 0.629 . . . . 0.0 111.716 -175.957 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.473 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 70.2 m-70 -87.65 136.56 32.9 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.878 -1.055 . . . . 0.0 108.595 175.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.731 ' O ' ' HB2' ' A' 3505 ' ' TYR . 63.9 t80 -64.77 141.09 58.89 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.632 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.1 t -115.3 -58.36 3.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 CA-C-O 121.386 0.612 . . . . 0.0 110.64 174.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.497 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 58.3 m -160.74 171.66 18.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.197 -171.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.59 -149.0 20.29 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.516 -0.849 . . . . 0.0 112.609 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.565 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.0 t-20 -101.6 111.54 23.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.599 0.237 . . . . 0.0 110.494 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -61.15 -31.7 71.42 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.589 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 23.6 t -63.16 -32.3 55.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.508 -178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.541 HD22 ' HD3' ' A' 3536 ' ' ARG . 28.8 mt -57.59 -39.44 76.81 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.086 177.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.456 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -67.38 -46.85 72.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.921 0.391 . . . . 0.0 110.297 179.288 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -63.58 -27.66 69.4 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.286 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3536 ' ' ARG . . . . . 0.541 ' HD3' HD22 ' A' 3533 ' ' LEU . 12.8 ptm180 -90.32 -14.92 32.18 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.468 ' O ' HG21 ' A' 3614 ' ' VAL . 21.7 p -103.78 -38.23 7.14 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.854 0.359 . . . . 0.0 111.949 -179.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.544 HD11 ' HB2' ' A' 3509 ' ' TRP . 19.4 mt -79.98 121.04 81.63 Favored Pre-proline 0 C--N 1.317 -0.815 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -175.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3539 ' ' PRO . . . . . 0.573 ' HB2' ' HG2' ' A' 3545 ' ' PRO . 6.6 Cg_endo -74.74 126.97 10.49 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.592 2.194 . . . . 0.0 113.667 -173.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 1.2 pt? -146.41 -163.92 1.86 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.402 177.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 40.3 m 78.51 -22.67 0.27 Allowed 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.578 0.751 . . . . 0.0 111.899 174.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -139.56 91.83 2.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.29 0.566 . . . . 0.0 111.217 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 70.66 -67.07 0.79 Allowed Glycine 0 CA--C 1.517 0.214 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.852 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 120.63 71.88 0.32 Allowed Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.831 -0.508 . . . . 0.0 111.831 -178.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3545 ' ' PRO . . . . . 0.573 ' HG2' ' HB2' ' A' 3539 ' ' PRO . 27.9 Cg_endo -63.76 127.48 19.74 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.421 2.081 . . . . 0.0 111.711 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 16.4 Cg_exo -66.42 145.52 77.41 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.608 2.206 . . . . 0.0 112.018 -178.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.546 ' HB3' HD12 ' A' 3612 ' ' ILE . 56.6 mt -74.09 112.25 10.04 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.932 177.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.648 ' HA ' ' O ' ' A' 3514 ' ' ALA . 16.2 ptt-85 -103.16 142.52 34.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.149 0.499 . . . . 0.0 111.003 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.491 ' CG2' HD11 ' B' 2521 ' ' LEU . 33.2 mt -95.86 108.76 21.58 Favored 'Isoleucine or valine' 0 C--O 1.245 0.855 0 CA-C-O 121.878 0.847 . . . . 0.0 112.016 -171.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.447 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.3 -1.28 15.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.966 -176.082 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.636 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 41.6 mt-30 -149.95 170.66 18.31 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.423 0.154 . . . . 0.0 111.038 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.715 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.14 141.21 17.34 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.934 0.397 . . . . 0.0 111.193 -179.68 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.591 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -110.6 121.39 45.2 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.402 178.239 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -63.34 110.68 1.99 Allowed 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.603 HD11 ' O ' ' A' 3555 ' ' LEU . 3.2 pp -70.16 99.54 1.51 Allowed 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 122.152 0.977 . . . . 0.0 109.791 -178.103 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.587 ' O ' ' HG ' ' A' 3560 ' ' LEU . 38.5 mt-10 -112.91 160.08 18.42 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.634 -1.166 . . . . 0.0 109.659 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.6 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -52.53 -52.36 55.12 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.414 0.446 . . . . 0.0 111.202 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 7.0 p -58.85 -42.38 89.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.42 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.531 ' O ' HG21 ' A' 3563 ' ' VAL . 23.2 mm-40 -62.1 -48.07 81.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.035 177.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' 3556 ' ' GLU . 87.0 mt -61.05 -34.46 74.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.404 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.6 ' HG2' ' O ' ' A' 3557 ' ' ALA . 29.6 mm-40 -59.38 -51.89 67.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.174 0.511 . . . . 0.0 109.878 175.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.31 -38.89 96.44 Favored Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.312 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.54 ' O ' ' HG3' ' A' 3567 ' ' MET . 83.9 t -61.24 -56.39 18.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.535 0.207 . . . . 0.0 110.644 178.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -65.23 -29.03 69.79 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -175.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.401 ' NH1' ' HB3' ' A' 3561 ' ' GLU . 72.2 mtt180 -75.9 -22.83 55.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3566 ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' 3563 ' ' VAL . 36.4 ptt180 -89.49 -12.32 40.4 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.669 169.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.54 ' HG3' ' O ' ' A' 3563 ' ' VAL . 78.1 mtp -81.72 -19.06 42.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.785 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 21.8 p -75.09 -19.23 60.06 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.408 0.623 . . . . 0.0 110.081 176.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.7 t -95.93 79.52 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.002 177.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.65 108.41 2.89 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.565 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 153.44 -43.24 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.52 1.528 . . . . 0.0 108.053 -175.179 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.25 -30.65 34.05 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.832 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.704 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -125.69 165.31 18.83 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.172 -179.891 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.583 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 25.4 t -127.09 135.79 51.25 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 171.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.632 HD23 ' CG1' ' A' 3527 ' ' VAL . 13.9 tp -106.16 125.17 50.66 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 178.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.539 HD13 HD23 ' A' 3524 ' ' LEU . 79.1 mt -127.19 151.78 48.24 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.149 0.499 . . . . 0.0 110.755 -177.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.683 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.03 108.68 14.59 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.473 ' HB3' HD13 ' A' 3659 ' ' ILE . . . -94.39 122.4 36.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.304 0.573 . . . . 0.0 110.431 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.586 HD21 HG22 ' A' 3650 ' ' ILE . 82.5 mt -122.13 140.83 33.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.184 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.88 112.72 1.44 Allowed 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.393 2.062 . . . . 0.0 111.819 178.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3581 ' ' CYS . . . . . 0.438 ' HB3' ' HG2' ' A' 3523 ' ' GLN . 25.7 p -99.75 118.47 36.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.116 0.484 . . . . 0.0 110.293 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3582 ' ' GLY . . . . . 0.43 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.33 145.57 16.26 Favored Glycine 0 N--CA 1.442 -0.948 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.652 -178.744 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -76.87 -31.23 56.66 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.907 0.86 . . . . 0.0 109.353 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.478 ' H ' ' HB3' ' A' 3587 ' ' ASP . 22.8 t70 -134.47 167.66 20.36 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.346 -178.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -54.6 -43.55 72.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.005 0.431 . . . . 0.0 110.348 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.32 -33.68 71.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.176 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.478 ' HB3' ' H ' ' A' 3584 ' ' ASP . 6.8 t70 -64.93 -42.77 94.39 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.468 HG22 ' O ' ' A' 3584 ' ' ASP . 93.8 t -56.28 -50.96 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.202 176.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 75.1 t -58.21 -50.51 78.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.695 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 42.1 t -55.43 -51.12 67.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.319 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -65.73 -36.98 85.13 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 121.22 -0.192 . . . . 0.0 111.225 -177.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3592 ' ' THR . . . . . 0.435 ' O ' ' HB3' ' A' 3596 ' ' LYS . 49.2 m -64.41 -44.71 90.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.957 0.408 . . . . 0.0 110.181 176.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3593 ' ' GLU . . . . . 0.443 ' HA ' ' CE ' ' A' 3596 ' ' LYS . 12.9 tp10 -61.01 -47.16 87.73 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.604 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 39.4 m -65.85 -47.72 73.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.047 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.563 HD11 HD13 ' A' 3657 ' ' LEU . 59.6 tp -59.5 -44.15 93.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.87 0.367 . . . . 0.0 110.73 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.692 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.9 OUTLIER -62.59 -35.76 80.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.262 -178.033 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3597 ' ' ALA . . . . . 0.41 ' O ' ' HB ' ' A' 3601 ' ' THR . . . -83.59 -41.18 18.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.728 0.299 . . . . 0.0 111.725 -178.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.483 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -86.57 -46.27 10.29 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -170.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.496 ' HB2' HD13 ' A' 3595 ' ' LEU . 19.6 m-85 -99.45 -50.5 4.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.711 0.291 . . . . 0.0 111.166 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.692 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.2 mm -60.88 -57.01 14.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.664 -176.882 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3601 ' ' THR . . . . . 0.41 ' HB ' ' O ' ' A' 3597 ' ' ALA . 91.7 m -56.29 -49.11 75.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.022 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.694 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.1 OUTLIER -59.52 -57.33 13.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.158 -179.489 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.694 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.3 OUTLIER -55.83 -42.28 75.49 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -178.52 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -75.85 -40.03 55.49 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.848 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -66.1 -46.43 77.64 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.988 0.423 . . . . 0.0 110.97 -178.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -77.74 -11.59 59.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.281 -178.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 50.36 63.22 2.29 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.255 -174.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.505 ' O ' HD12 ' A' 3603 ' ' LEU . . . -138.35 -176.28 4.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.213 0.53 . . . . 0.0 112.317 -173.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.715 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -122.89 117.78 26.37 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.33 174.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3610 ' ' GLY . . . . . 0.451 ' N ' HD13 ' A' 3603 ' ' LEU . . . -64.36 103.7 0.78 Allowed Glycine 0 C--O 1.222 -0.621 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.499 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.636 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.8 mm -89.42 124.33 42.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 121.212 0.53 . . . . 0.0 110.659 -175.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.546 HD12 ' HB3' ' A' 3547 ' ' LEU . 62.1 mt -124.2 105.99 16.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.108 177.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.507 ' HA ' ' O ' ' A' 3624 ' ' TYR . 7.1 m120 -80.77 112.31 18.03 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.468 HG21 ' O ' ' A' 3537 ' ' SER . 6.2 p -113.58 127.58 26.66 Favored Pre-proline 0 C--N 1.311 -1.068 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.815 -177.368 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.546 ' HB2' ' HA ' ' A' 3620 ' ' ASN . 79.2 Cg_endo -83.12 136.8 8.1 Favored 'Trans proline' 0 N--CA 1.448 -1.193 0 C-N-CA 122.38 2.053 . . . . 0.0 111.808 173.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.407 ' HA ' ' HD3' ' A' 3617 ' ' PRO . 8.5 p30 -62.72 115.88 19.91 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.028 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3617 ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' 3616 ' ' ASN . 77.8 Cg_exo -49.94 123.87 11.57 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.367 2.711 . . . . 0.0 112.821 -174.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 109.42 -50.99 0.73 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.003 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 1.7 p -97.27 -25.81 15.13 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.822 0.344 . . . . 0.0 110.99 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3620 ' ' ASN . . . . . 0.546 ' HA ' ' HB2' ' A' 3615 ' ' PRO . 21.4 t-20 59.75 72.61 0.52 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.579 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.54 ' O ' ' HA ' ' A' 3615 ' ' PRO . 94.5 mt-30 -127.0 109.27 21.86 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.126 171.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3622 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.63 24.5 0.46 Allowed 'Trans proline' 0 C--O 1.234 0.321 0 C-N-CA 123.413 2.742 . . . . 0.0 113.606 -173.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -75.99 47.47 0.44 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.87 0.367 . . . . 0.0 111.914 -178.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.507 ' O ' ' HA ' ' A' 3613 ' ' ASN . 78.7 m-85 -141.34 133.53 27.93 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.373 176.273 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 20.1 t -116.1 114.98 47.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.935 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.586 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -99.45 115.44 29.28 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 168.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.48 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 97.9 mt-30 -94.66 111.32 23.09 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.04 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.583 HG12 HG12 ' A' 3659 ' ' ILE . 43.9 mt -90.46 98.46 8.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.961 178.096 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -88.48 145.04 34.66 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.085 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.548 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.3 Cg_endo -69.91 172.84 12.04 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.744 2.296 . . . . 0.0 111.901 177.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -70.88 46.69 0.66 Allowed 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 122.97 2.447 . . . . 0.0 112.272 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.5 p -80.66 162.63 24.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.276 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -53.73 -38.96 64.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.012 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 32.0 t80 -49.69 -50.04 45.26 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 121.284 0.564 . . . . 0.0 110.95 174.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 4.1 m -64.95 -52.9 53.77 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.153 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -52.19 -50.65 61.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.143 -176.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 51.3 p -60.56 -50.45 73.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.174 0.512 . . . . 0.0 110.711 -175.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 72.1 m80 -66.3 -36.24 82.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.975 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 76.4 mt -64.29 -34.67 78.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.052 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.969 ' HA ' HD23 ' A' 3647 ' ' LEU . 34.8 m -64.12 -37.1 86.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.224 0.535 . . . . 0.0 110.412 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.82 -51.11 9.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.202 178.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.581 HD12 HD21 ' A' 3575 ' ' LEU . 30.1 mt -72.45 -34.39 67.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.789 -171.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.425 ' HB2' ' CZ ' ' A' 3505 ' ' TYR . . . -151.35 84.39 5.22 Favored Pre-proline 0 C--N 1.328 -0.334 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -73.52 -23.12 17.56 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.6 2.2 . . . . 0.0 113.372 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 12.3 t0 -76.46 -52.91 8.91 Favored 'General case' 0 CA--C 1.515 -0.365 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 -175.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.683 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -69.79 -28.32 65.64 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 178.625 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.969 HD23 ' HA ' ' A' 3640 ' ' SER . 31.7 tp -51.12 -50.13 59.45 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.914 174.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.33 -23.75 65.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.179 -178.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 12.9 m -83.43 -36.38 24.26 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.436 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.586 HG22 HD21 ' A' 3579 ' ' LEU . 4.3 pt -81.31 -17.28 12.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.487 -177.09 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 49.6 m -58.44 -22.55 54.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.91 175.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3652 ' ' ASN . . . . . 0.41 ' N ' HD21 ' A' 3652 ' ' ASN . 0.9 OUTLIER -89.28 -37.09 15.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.016 0.436 . . . . 0.0 110.787 174.454 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.501 HG21 ' HA ' ' A' 3650 ' ' ILE . 7.5 tp -104.51 39.76 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 122.473 1.13 . . . . 0.0 109.307 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.461 ' N ' ' HD2' ' A' 3655 ' ' PRO . 20.2 m -35.53 -44.57 0.84 Allowed Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 113.784 -1.553 . . . . 0.0 114.038 173.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' 3654 ' ' SER . 20.2 Cg_endo -62.46 76.12 0.1 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.541 1.494 . . . . 0.0 112.008 171.199 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 34.6 p80 -145.65 175.47 10.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.121 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.563 HD13 HD11 ' A' 3595 ' ' LEU . 21.6 mt -120.6 152.32 38.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.77 -177.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 57.4 ttp -112.0 109.51 19.31 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.583 HG12 HG12 ' A' 3628 ' ' ILE . 81.1 mt -102.67 116.63 46.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 121.317 0.58 . . . . 0.0 111.325 -172.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.704 HG13 ' HD2' ' A' 3573 ' ' TYR . 82.1 t -102.47 115.28 44.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.023 -178.19 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.586 HG12 ' HG ' ' A' 3626 ' ' LEU . 64.3 mt -90.9 121.85 41.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -123.68 126.54 46.75 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.722 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.5 m -104.93 110.47 22.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.832 169.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.03 -178.276 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.591 ' CD1' ' HB2' ' A' 3553 ' ' MET . 31.9 m-85 . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.485 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.5 OUTLIER 54.22 -162.97 0.12 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 122.022 0.915 . . . . 0.0 112.16 177.318 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 1.2 p -144.25 116.72 8.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.096 -1.411 . . . . 0.0 108.225 167.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.634 HD13 ' H ' ' B' 2522 ' ' SEP . 0.2 OUTLIER -76.18 -133.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.457 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.677 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 20.9 p-10 -97.66 -49.54 4.81 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.951 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 2.7 mp0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.203 -0.903 . . . . 0.0 109.765 176.693 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.709 ' HA ' ' HB3' ' A' 3649 ' ' SER . 13.4 m . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 121.214 0.531 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 20.8 t70 -88.65 113.6 24.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.939 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.449 ' O ' HD11 ' A' 3502 ' ' LEU . 1.9 mpp? -75.32 -23.77 57.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.742 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 39.6 t -65.71 -24.66 34.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.935 -176.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -81.08 -61.14 2.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.066 0.46 . . . . 0.0 110.679 175.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.495 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.1 pp -66.1 -31.37 72.2 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -171.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.629 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.76 -17.32 64.5 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.436 -174.107 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.629 ' N ' HD12 ' A' 3502 ' ' LEU . 22.8 tptm -68.42 -28.15 66.82 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.065 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 32.0 tptt -103.17 -42.29 5.81 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.257 0.551 . . . . 0.0 109.894 179.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.73 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -146.26 97.16 4.45 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.553 -178.219 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -79.67 173.06 13.44 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.573 2.848 . . . . 0.0 113.524 -176.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.523 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.0 mt -73.0 137.2 23.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.132 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3508 ' ' VAL . . . . . 0.411 HG12 ' HB2' ' A' 3526 ' ' PHE . 27.5 m -105.11 -31.37 2.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.654 -178.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.697 ' HE3' HD13 ' A' 3524 ' ' LEU . 18.2 t90 -145.33 155.69 43.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.793 0.33 . . . . 0.0 110.825 -174.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -150.56 120.6 7.19 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 176.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -174.18 -132.32 1.53 Allowed Glycine 0 N--CA 1.444 -0.818 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -178.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.601 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.4 mp -138.1 155.69 48.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.058 0.456 . . . . 0.0 110.989 178.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.5 HD21 ' HB2' ' A' 3547 ' ' LEU . 91.2 mt -109.03 146.15 34.41 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 169.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.699 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.37 126.84 16.82 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.465 0.174 . . . . 0.0 110.918 -179.224 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.802 HD13 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.53 141.4 39.32 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 172.619 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.802 ' CD ' HD13 ' A' 3515 ' ' LEU . 0.5 OUTLIER 62.85 -86.99 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.196 0.598 . . . . 0.0 109.908 -171.532 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 2.5 m120 -149.81 11.9 0.76 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.185 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' 3514 ' ' ALA . 16.5 m-20 -103.0 139.4 38.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.358 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.474 HG22 ' HB1' ' A' 3514 ' ' ALA . 37.5 p -127.12 143.13 51.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.108 0.48 . . . . 0.0 111.71 -175.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -139.55 114.69 9.65 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.396 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.586 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -68.97 120.61 15.11 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 177.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.435 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 31.4 m -129.87 148.28 33.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 121.582 0.706 . . . . 0.0 112.181 -174.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -108.72 125.52 52.0 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 114.849 -1.068 . . . . 0.0 108.827 171.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.697 HD13 ' HE3' ' A' 3509 ' ' TRP . 2.1 mt -93.98 114.2 26.35 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.371 0.605 . . . . 0.0 111.637 -176.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.523 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 48.3 m80 -89.5 142.4 27.7 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.747 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.73 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.1 t80 -70.32 135.28 48.73 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 171.307 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.634 ' CG1' HD22 ' A' 3575 ' ' LEU . 24.3 t -114.33 -57.0 3.99 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-O 121.467 0.651 . . . . 0.0 110.283 176.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.567 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 66.1 m -160.0 171.21 19.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.111 -172.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 86.3 -152.57 25.61 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.432 -0.89 . . . . 0.0 111.744 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.552 ' HB2' ' HA ' ' A' 3571 ' ' THR . 3.4 t-20 -102.13 117.76 35.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.115 0.458 . . . . 0.0 110.758 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -65.24 -28.56 69.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.176 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 61.0 t -59.52 -33.13 50.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.477 178.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.527 HD21 ' HD3' ' A' 3536 ' ' ARG . 18.7 mt -58.94 -41.55 87.64 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.092 177.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.407 ' HB1' ' CD1' ' A' 3538 ' ' LEU . . . -69.23 -40.0 78.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.935 0.397 . . . . 0.0 110.361 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -65.45 -32.68 74.42 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.76 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3536 ' ' ARG . . . . . 0.527 ' HD3' HD21 ' A' 3533 ' ' LEU . 11.2 ptm180 -90.13 -11.63 40.64 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3537 ' ' SER . . . . . . . . . . . . . 26.7 p -104.12 -43.33 5.28 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.542 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.568 HD12 ' HB2' ' A' 3509 ' ' TRP . 35.8 mt -78.82 111.94 23.45 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-O 121.228 0.537 . . . . 0.0 110.033 -172.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3539 ' ' PRO . . . . . 0.504 ' HD3' HG21 ' A' 3614 ' ' VAL . 97.3 Cg_endo -85.26 168.91 10.1 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.101 2.534 . . . . 0.0 112.793 -172.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.699 ' HA ' ' HG3' ' A' 3545 ' ' PRO . 3.8 pp -171.37 164.56 7.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.205 176.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 17.8 t -148.09 -42.55 0.16 Allowed 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 173.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -114.65 -158.9 0.68 Allowed 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.198 -0.91 . . . . 0.0 108.858 171.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . -75.62 59.29 2.93 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.953 -0.641 . . . . 0.0 113.581 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 105.42 107.46 3.22 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.89 173.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3545 ' ' PRO . . . . . 0.699 ' HG3' ' HA ' ' A' 3540 ' ' LEU . 68.7 Cg_endo -92.12 170.97 2.67 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 123.448 2.765 . . . . 0.0 111.74 170.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.601 ' HA ' ' O ' ' A' 3512 ' ' LEU . 19.6 Cg_endo -95.79 123.65 0.29 Allowed 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 122.976 2.45 . . . . 0.0 113.455 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.587 ' HB3' HD13 ' A' 3612 ' ' ILE . 26.7 mt -79.32 122.98 27.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.637 172.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.699 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -102.84 143.85 31.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 111.816 -174.571 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.519 ' CG2' HD11 ' B' 2521 ' ' LEU . 21.8 mt -98.93 107.45 20.52 Favored 'Isoleucine or valine' 0 C--O 1.248 0.978 0 CA-C-O 122.251 1.024 . . . . 0.0 111.903 -174.055 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.49 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -114.79 1.96 14.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.972 -174.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.667 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 66.8 mt-30 -148.99 172.47 14.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.476 0.179 . . . . 0.0 111.209 178.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.734 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.75 139.91 15.53 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.082 0.468 . . . . 0.0 111.621 -179.273 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.54 ' HB3' ' HB2' ' A' 3609 ' ' ALA . 19.4 ttt -108.17 125.46 51.65 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.352 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -64.0 111.25 2.43 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 177.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.559 HD11 ' O ' ' A' 3555 ' ' LEU . 3.2 pp -76.57 98.56 4.71 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 122.413 1.102 . . . . 0.0 109.476 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' A' 3560 ' ' LEU . 44.1 mt-10 -108.22 159.06 16.91 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.29 176.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -58.64 -41.69 86.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.473 0.654 . . . . 0.0 109.277 175.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3558 ' ' THR . . . . . 0.418 ' O ' ' HB2' ' A' 3561 ' ' GLU . 0.7 OUTLIER -62.27 -41.23 98.28 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.827 177.882 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.523 ' O ' HG22 ' A' 3563 ' ' VAL . 17.2 mm-40 -70.28 -41.53 73.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.698 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' 3556 ' ' GLU . 85.4 mt -61.58 -35.31 77.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.501 178.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.418 ' HB2' ' O ' ' A' 3558 ' ' THR . 45.2 mm-40 -55.28 -51.35 66.94 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.136 172.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.37 -44.39 98.11 Favored Glycine 0 CA--C 1.519 0.29 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.432 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.523 HG22 ' O ' ' A' 3559 ' ' GLN . 57.3 t -59.54 -52.43 61.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.503 0.192 . . . . 0.0 110.616 179.01 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3564 ' ' ALA . . . . . 0.53 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.96 -32.25 71.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.026 0.441 . . . . 0.0 111.046 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.47 ' O ' HG23 ' A' 3568 ' ' THR . 41.8 ttp180 -63.06 -38.27 90.52 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.167 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 25.2 ptt180 -88.5 -10.86 47.54 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.899 -0.32 . . . . 0.0 111.282 175.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.53 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 65.0 mtp -80.14 -26.55 39.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.975 177.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3568 ' ' THR . . . . . 0.47 HG23 ' O ' ' A' 3565 ' ' ARG . 8.5 t -74.73 -9.43 58.55 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.983 0.42 . . . . 0.0 110.834 -177.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 40.8 t -111.26 87.63 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.302 0.572 . . . . 0.0 110.236 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.15 110.42 4.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.178 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.552 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.6 m 150.94 -40.62 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.747 1.619 . . . . 0.0 107.825 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -80.69 -30.83 36.41 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.629 -179.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.655 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.2 OUTLIER -126.72 166.5 17.28 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.058 178.626 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.582 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 33.7 t -129.27 135.81 49.26 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 171.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.634 HD22 ' CG1' ' A' 3527 ' ' VAL . 9.4 tp -105.87 124.8 50.15 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 177.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.497 HD13 HD22 ' A' 3524 ' ' LEU . 80.9 mt -125.1 158.1 34.67 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.038 0.447 . . . . 0.0 110.888 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.736 ' HG ' HD13 ' A' 3646 ' ' LEU . 0.3 OUTLIER -125.74 106.9 10.04 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.391 -179.365 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.49 ' HB1' HD11 ' A' 3659 ' ' ILE . . . -94.61 123.64 38.17 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.324 0.583 . . . . 0.0 110.605 -177.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.445 HD21 ' HB2' ' A' 3656 ' ' HIS . 39.5 mt -126.42 145.05 51.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 114.706 -1.133 . . . . 0.0 109.912 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -60.23 111.38 0.99 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 122.323 2.016 . . . . 0.0 112.079 177.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.1 p -96.5 113.22 24.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.16 0.505 . . . . 0.0 109.975 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3582 ' ' GLY . . . . . 0.45 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -96.36 146.15 18.13 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.111 -175.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -73.31 -15.48 61.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.935 0.874 . . . . 0.0 109.417 177.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.625 ' O ' HG22 ' A' 3588 ' ' VAL . 16.7 t70 -158.35 167.03 30.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.113 -1.403 . . . . 0.0 107.22 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -58.62 -40.9 84.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 118.144 0.429 . . . . 0.0 110.47 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.51 -37.23 86.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.513 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' 3591 ' ' GLN . 17.1 t70 -63.45 -44.26 95.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.769 178.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.625 HG22 ' O ' ' A' 3584 ' ' ASP . 58.1 t -54.1 -42.52 55.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.727 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 5.4 t -62.75 -49.27 84.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.629 0.728 . . . . 0.0 109.571 -178.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 55.8 m -62.74 -39.9 95.53 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.765 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3591 ' ' GLN . . . . . 0.489 HE21 ' HB2' ' A' 3521 ' ' ALA . 13.7 mm100 -70.56 -39.48 73.92 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.358 -0.214 . . . . 0.0 110.972 179.075 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 73.8 m -60.14 -50.32 74.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.842 0.353 . . . . 0.0 111.157 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3593 ' ' GLU . . . . . 0.518 ' HA ' ' HG2' ' A' 3596 ' ' LYS . 11.4 pt-20 -66.76 -30.89 71.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.166 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 50.5 m -70.54 -40.47 73.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.089 0.471 . . . . 0.0 110.219 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.558 HD13 HD12 ' A' 3657 ' ' LEU . 59.5 tp -65.61 -46.16 80.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.09 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.782 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 19.9 ptmt -65.65 -34.39 78.11 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.256 -178.09 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -78.17 -39.19 41.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.671 0.272 . . . . 0.0 111.393 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.476 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -91.05 -46.26 8.23 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -172.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.481 ' HB2' HD11 ' A' 3595 ' ' LEU . 19.1 m-85 -99.01 -50.37 4.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.774 0.321 . . . . 0.0 111.533 -174.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.782 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 23.2 mm -61.91 -58.13 8.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.067 -175.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 87.7 m -57.55 -42.54 83.19 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.147 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.824 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -62.43 -57.37 11.5 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 121.366 -0.133 . . . . 0.0 110.979 178.325 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.824 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.1 OUTLIER -57.13 -39.2 74.69 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.58 0.229 . . . . 0.0 111.466 -176.322 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -77.53 -38.13 49.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.748 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.74 -35.56 75.08 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.966 0.413 . . . . 0.0 111.129 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3606 ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' 3602 ' ' TYR . 27.1 mmmt -87.71 -9.09 55.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.931 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 47.33 63.45 1.97 Allowed 'General case' 0 C--O 1.235 0.328 0 O-C-N 123.764 0.665 . . . . 0.0 111.266 -177.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.485 ' HB1' ' HB2' ' A' 3552 ' ' ARG . . . -143.23 -177.42 5.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.009 -0.541 . . . . 0.0 112.027 -175.407 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.734 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -116.04 118.25 32.37 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.164 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3610 ' ' GLY . . . . . 0.451 ' N ' HD13 ' A' 3603 ' ' LEU . . . -63.07 102.73 0.55 Allowed Glycine 0 C--O 1.223 -0.547 0 C-N-CA 120.718 -0.753 . . . . 0.0 111.343 178.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.667 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.6 mm -89.55 123.84 41.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.238 0.542 . . . . 0.0 110.795 -175.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.587 HD13 ' HB3' ' A' 3547 ' ' LEU . 53.8 mt -119.23 106.79 19.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.739 175.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.445 ' HA ' ' O ' ' A' 3624 ' ' TYR . 4.1 m120 -82.97 106.85 15.14 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 175.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.504 HG21 ' HD3' ' A' 3539 ' ' PRO . 9.3 p -109.12 133.52 20.72 Favored Pre-proline 0 C--N 1.312 -1.058 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.143 -171.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.565 ' HB2' ' HA ' ' A' 3620 ' ' ASN . 71.8 Cg_endo -80.13 133.38 9.88 Favored 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 121.995 1.797 . . . . 0.0 111.612 171.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3616 ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -55.09 123.07 46.06 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.718 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.56 107.61 0.26 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.391 2.061 . . . . 0.0 111.434 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 115.79 -48.21 0.96 Allowed Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.599 -177.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 5.7 m -96.82 -20.86 17.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.678 0.239 . . . . 0.0 111.171 -176.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3620 ' ' ASN . . . . . 0.565 ' HA ' ' HB2' ' A' 3615 ' ' PRO . 86.2 m-20 63.7 26.28 14.48 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.782 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3621 ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -88.14 111.77 45.12 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.065 176.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.472 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 85.7 Cg_endo -84.87 23.29 0.85 Allowed 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 123.32 2.68 . . . . 0.0 113.565 -173.085 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -82.28 53.4 2.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.772 0.32 . . . . 0.0 111.449 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.445 ' O ' ' HA ' ' A' 3613 ' ' ASN . 79.0 m-85 -143.44 133.78 24.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.061 0.458 . . . . 0.0 110.52 178.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.448 HG12 HD12 ' A' 3611 ' ' ILE . 15.5 t -113.39 114.28 46.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.972 176.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.608 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.4 mp -100.41 113.44 26.2 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.471 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 14.3 mt-30 -94.68 110.38 22.22 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.647 -178.731 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.584 HG12 HG12 ' A' 3659 ' ' ILE . 40.5 mt -91.82 98.19 8.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.072 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -88.58 141.71 30.49 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.297 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.644 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 57.2 Cg_endo -71.31 164.6 35.2 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.572 2.182 . . . . 0.0 111.504 176.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3631 ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' 3656 ' ' HIS . 44.3 Cg_endo -67.26 85.86 0.33 Allowed 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.799 2.333 . . . . 0.0 112.016 178.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.542 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.1 p -112.4 162.12 15.92 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.002 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -55.74 -33.78 64.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.684 0.278 . . . . 0.0 110.305 179.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.97 -42.58 80.65 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.084 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3635 ' ' SER . . . . . 0.452 ' O ' ' HG ' ' A' 3639 ' ' LEU . 58.7 p -65.32 -52.55 53.22 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.105 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3636 ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' 3632 ' ' CYS . 5.6 mm-40 -63.68 -35.53 80.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.402 -175.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 14.3 p -64.56 -54.69 28.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.606 -176.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -71.34 -19.47 62.29 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 118.871 -1.132 . . . . 0.0 110.733 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3639 ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' 3635 ' ' SER . 41.9 mt -64.9 -35.84 82.44 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.23 172.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.512 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 18.1 m -70.31 -31.83 69.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.423 0.63 . . . . 0.0 109.941 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -76.06 -43.92 41.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.849 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.572 HD11 HD21 ' A' 3575 ' ' LEU . 17.9 mt -85.21 -38.96 18.34 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.512 -0.767 . . . . 0.0 112.753 -172.129 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.463 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -147.85 82.92 7.66 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.899 0.381 . . . . 0.0 111.556 -177.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.59 -28.06 21.74 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.069 2.513 . . . . 0.0 113.882 -174.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 4.2 t0 -77.73 -37.93 48.19 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.33 -172.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.736 HD13 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -80.03 -31.17 39.57 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 175.184 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.514 ' HA ' HG12 ' A' 3650 ' ' ILE . 3.3 tm? -54.04 -43.69 70.39 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.452 177.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -62.05 -25.76 67.87 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.382 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.709 ' HB3' ' HA ' ' A' 3496 ' ' VAL . 73.3 m -78.92 -40.23 32.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.026 0.441 . . . . 0.0 110.598 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.633 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.8 pt -82.79 -18.32 10.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.818 -172.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.9 t -59.08 -25.69 63.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -88.84 -35.0 16.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.919 0.39 . . . . 0.0 110.617 174.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.633 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.4 OUTLIER -98.84 30.97 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 122.81 1.291 . . . . 0.0 109.083 -175.56 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.427 ' N ' ' HD2' ' A' 3655 ' ' PRO . 18.7 m -30.03 -42.88 0.2 Allowed Pre-proline 0 CA--C 1.542 0.657 0 CA-C-N 113.763 -1.562 . . . . 0.0 114.851 173.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.429 ' HG2' HD11 ' A' 3653 ' ' ILE . 15.9 Cg_endo -60.55 65.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.849 1.699 . . . . 0.0 112.345 168.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3656 ' ' HIS . . . . . 0.445 ' HB2' HD21 ' A' 3579 ' ' LEU . 23.6 p80 -136.37 174.15 10.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.866 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.558 HD12 HD13 ' A' 3595 ' ' LEU . 31.6 mt -119.93 149.12 42.63 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.765 0.317 . . . . 0.0 110.853 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 51.8 ttp -112.88 110.94 21.35 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.584 HG12 HG12 ' A' 3628 ' ' ILE . 71.0 mt -105.63 118.35 52.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.153 0.501 . . . . 0.0 111.42 -172.125 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.655 HG12 ' HD2' ' A' 3573 ' ' TYR . 77.2 t -103.18 116.76 47.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.805 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.608 HG12 ' HG ' ' A' 3626 ' ' LEU . 59.1 mt -90.95 114.98 29.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.11 127.94 56.35 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.852 0.358 . . . . 0.0 111.443 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 8.5 m -70.1 137.94 51.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.831 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.518 179.154 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.488 ' CD1' ' HB2' ' A' 3553 ' ' MET . 38.1 m-85 . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.531 ' O ' ' HG2' ' A' 3551 ' ' GLN . 1.3 tp10 55.29 -160.81 0.17 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.139 0.495 . . . . 0.0 110.897 175.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 7.7 p -144.2 129.9 19.19 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 167.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.519 HD11 ' CG2' ' A' 3549 ' ' ILE . 0.2 OUTLIER -82.6 -126.21 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.498 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2523 ' ' ASP . . . . . 0.477 ' CG ' ' H ' ' B' 2524 ' ' SEP . 9.0 t70 -161.3 -156.19 0.44 Allowed 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -175.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B 2524 ' ' SEP . . . . . 0.477 ' H ' ' CG ' ' B' 2523 ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.03 177.3 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.563 ' HB ' ' OE1' ' A' 3500 ' ' GLN . 34.0 m . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 33.8 t70 -80.59 147.65 30.65 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.737 -0.21 . . . . 0.0 110.689 -177.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.444 ' HA ' ' CD2' ' A' 3501 ' ' LEU . 73.6 mtm -62.87 -30.72 71.73 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -178.242 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.492 ' HA ' HD12 ' A' 3502 ' ' LEU . 88.8 t -64.76 -22.32 31.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.604 0.716 . . . . 0.0 110.468 177.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3500 ' ' GLN . . . . . 0.563 ' OE1' ' HB ' ' A' 3496 ' ' VAL . 51.8 mt-30 -79.21 -52.07 8.65 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.508 174.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.509 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp -67.29 -35.28 79.14 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -173.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.765 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -73.12 -15.53 61.48 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.098 -0.641 . . . . 0.0 110.477 -174.202 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.576 ' N ' HD11 ' A' 3502 ' ' LEU . 55.5 tptt -68.13 -28.33 67.22 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 175.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3504 ' ' LYS . . . . . 0.434 ' HB3' ' CE2' ' A' 3505 ' ' TYR . 4.3 mmmm -92.26 -42.96 9.55 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.776 175.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.718 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -153.5 108.6 2.57 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.812 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3506 ' ' PRO . . . . . 0.765 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 94.0 Cg_endo -87.49 173.55 5.38 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 124.127 3.218 . . . . 0.0 114.025 -175.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.423 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.3 mt -72.11 132.71 33.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.61 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3508 ' ' VAL . . . . . 0.428 HG12 ' HB2' ' A' 3526 ' ' PHE . 31.0 m -103.4 -31.15 2.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.596 -177.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.701 ' HE3' HD12 ' A' 3524 ' ' LEU . 47.3 t90 -147.56 153.64 39.7 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -175.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3510 ' ' GLN . . . . . 0.459 ' HG3' ' HB3' ' A' 3523 ' ' GLN . 21.7 tt0 -151.25 120.01 6.57 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -176.13 -123.29 0.76 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.657 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.5 mp -141.04 157.12 45.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.059 0.457 . . . . 0.0 111.059 179.156 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.437 HD23 ' HB2' ' A' 3547 ' ' LEU . 92.3 mt -108.91 151.29 26.48 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 168.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.727 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -147.65 126.92 13.02 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.74 0.305 . . . . 0.0 111.465 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.829 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.28 141.84 41.95 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 172.914 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.829 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.6 OUTLIER 63.6 -92.12 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -169.446 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 11.5 m120 -147.22 15.1 1.15 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 172.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.48 ' O ' ' HA ' ' A' 3514 ' ' ALA . 4.9 m-20 -96.02 123.26 39.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.361 -176.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.422 HG21 ' HB3' ' A' 3514 ' ' ALA . 37.0 p -113.75 138.77 49.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.074 0.464 . . . . 0.0 111.63 -177.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.97 116.11 14.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.473 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.613 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.73 122.94 20.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.97 0.414 . . . . 0.0 110.333 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' 3579 ' ' LEU . 35.2 m -132.43 149.03 31.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.915 -175.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3523 ' ' GLN . . . . . 0.459 ' HB3' ' HG3' ' A' 3510 ' ' GLN . 11.2 pt20 -112.45 127.59 56.08 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 170.006 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.701 HD12 ' HE3' ' A' 3509 ' ' TRP . 1.2 mt -95.35 113.3 24.95 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.039 -174.601 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.423 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 80.2 m-70 -88.0 136.31 33.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.714 175.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.718 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.1 t80 -67.67 139.55 56.78 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 174.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.615 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.5 t -115.1 -58.11 3.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 121.387 0.613 . . . . 0.0 110.979 176.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.431 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 65.0 m -159.69 171.91 18.7 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.275 -171.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.36 -152.02 23.11 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.632 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.581 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.6 t-20 -100.24 112.89 25.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.843 0.354 . . . . 0.0 110.608 -178.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -64.67 -32.08 73.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.495 -176.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 39.9 t -59.47 -32.37 48.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.42 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.441 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 20.3 mt -58.42 -45.81 87.69 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.775 176.12 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -66.6 -40.84 89.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.112 0.482 . . . . 0.0 110.076 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 14.7 t60 -57.57 -41.73 81.68 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.707 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -89.19 -14.32 36.32 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -176.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.45 ' O ' HG23 ' A' 3614 ' ' VAL . 42.4 p -96.81 -39.25 9.52 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 121.981 -0.449 . . . . 0.0 111.617 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.572 HD11 ' HB2' ' A' 3509 ' ' TRP . 31.1 mt -80.43 108.65 10.21 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-O 120.926 0.393 . . . . 0.0 109.978 -175.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -74.9 147.49 34.45 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.854 2.369 . . . . 0.0 113.06 -171.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.487 HD23 ' CD1' ' A' 3509 ' ' TRP . 3.2 pp -175.51 154.78 1.69 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.251 178.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 13.3 m -135.64 -40.7 0.7 Allowed 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.826 -1.079 . . . . 0.0 108.206 170.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -146.6 98.23 3.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.438 173.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 93.35 -107.16 3.5 Favored Glycine 0 N--CA 1.442 -0.933 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 -174.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 175.59 112.96 0.31 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.261 -0.971 . . . . 0.0 113.059 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.39 150.79 70.89 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 123.138 2.559 . . . . 0.0 111.729 176.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.657 ' HA ' ' O ' ' A' 3512 ' ' LEU . 34.8 Cg_endo -64.01 124.75 14.01 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 C-N-CA 122.691 2.261 . . . . 0.0 113.439 -175.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.605 ' HB3' HD12 ' A' 3612 ' ' ILE . 29.1 mt -69.24 124.18 23.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.84 173.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.727 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -105.05 142.49 34.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.782 0.325 . . . . 0.0 111.773 -173.903 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.517 ' CG2' HD12 ' B' 2521 ' ' LEU . 34.9 mt -98.89 107.03 19.76 Favored 'Isoleucine or valine' 0 C--O 1.254 1.298 0 CA-C-O 122.608 1.194 . . . . 0.0 112.069 -172.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.444 ' HA ' ' HB2' ' B' 2523 ' ' ASP . . . -107.34 -9.04 16.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.614 -1.175 . . . . 0.0 111.949 -173.463 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.618 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 58.8 mt-30 -146.29 175.2 10.7 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.951 -0.113 . . . . 0.0 110.859 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.68 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.32 137.0 13.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.87 0.367 . . . . 0.0 111.353 -179.558 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.558 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.6 tmm? -108.17 113.79 27.19 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.174 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3554 ' ' ARG . . . . . 0.504 ' O ' ' HG3' ' A' 3556 ' ' GLU . 14.1 mmt180 -62.52 110.34 1.66 Allowed 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 175.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.489 HD11 ' O ' ' A' 3555 ' ' LEU . 2.3 pp -68.29 97.96 0.78 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.304 1.05 . . . . 0.0 109.809 -173.634 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.61 ' O ' ' HG ' ' A' 3560 ' ' LEU . 41.5 mt-10 -95.34 154.41 17.21 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.256 -1.338 . . . . 0.0 109.482 -178.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.601 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.49 -42.68 74.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.22 0.534 . . . . 0.0 109.725 174.047 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 19.3 m -63.26 -41.5 99.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.945 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.573 ' O ' HG21 ' A' 3563 ' ' VAL . 27.7 mm-40 -62.97 -48.34 79.29 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.435 177.262 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' 3556 ' ' GLU . 69.5 mt -59.02 -35.87 74.0 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.288 0.367 . . . . 0.0 110.873 -178.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.601 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.9 mm-40 -57.97 -51.72 68.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.428 0.632 . . . . 0.0 110.497 174.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -63.95 -40.1 97.95 Favored Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.226 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.666 ' O ' ' HG3' ' A' 3567 ' ' MET . 73.2 t -59.62 -48.18 88.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 176.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -53.67 -42.7 68.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.196 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.561 ' O ' ' HB ' ' A' 3568 ' ' THR . 96.4 mtt180 -60.42 -44.46 95.74 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.851 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -76.55 -15.3 59.9 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.087 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.666 ' HG3' ' O ' ' A' 3563 ' ' VAL . 88.0 mtp -83.74 -19.19 35.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.687 0.756 . . . . 0.0 109.126 173.016 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3568 ' ' THR . . . . . 0.561 ' HB ' ' O ' ' A' 3565 ' ' ARG . 56.2 m -77.06 -21.59 54.23 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.009 176.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 60.5 t -116.45 84.51 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.9 177.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.0 108.13 3.4 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.581 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 1.9 m 157.88 -42.99 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.249 1.42 . . . . 0.0 108.02 -173.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -84.8 -17.36 38.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.025 -177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.714 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.1 OUTLIER -138.17 163.9 30.54 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 120.979 0.419 . . . . 0.0 109.994 177.401 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.585 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 29.3 t -126.12 135.64 51.94 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 172.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.615 HD23 ' CG1' ' A' 3527 ' ' VAL . 13.3 tp -105.97 125.54 51.11 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.534 HD11 HD22 ' A' 3524 ' ' LEU . 82.2 mt -126.72 154.89 43.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.11 0.481 . . . . 0.0 110.837 -177.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.612 ' HG ' HD13 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.83 108.02 13.43 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.611 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.481 ' HB3' HD12 ' A' 3659 ' ' ILE . . . -94.68 122.42 37.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.299 0.571 . . . . 0.0 110.495 -177.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.556 HD22 HG23 ' A' 3653 ' ' ILE . 83.4 mt -126.75 142.01 42.08 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.688 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3580 ' ' PRO . . . . . 0.454 ' HA ' ' O ' ' A' 3521 ' ' ALA . 20.5 Cg_endo -60.46 117.3 4.05 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 122.67 2.247 . . . . 0.0 112.091 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.4 p -101.58 107.8 19.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.272 0.558 . . . . 0.0 111.003 -177.074 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.71 146.18 16.34 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.604 -179.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 5.2 ttp85 -64.72 -35.29 80.57 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.596 0.712 . . . . 0.0 110.064 176.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.574 ' O ' HG21 ' A' 3588 ' ' VAL . 15.1 t70 -134.92 164.37 27.75 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -55.42 -38.38 68.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 117.994 0.361 . . . . 0.0 110.392 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -62.2 -44.64 96.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.507 176.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 24.4 t0 -63.71 -40.87 97.84 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.013 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.574 HG21 ' O ' ' A' 3584 ' ' ASP . 91.4 t -57.04 -48.55 81.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.043 176.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 65.5 t -57.36 -48.73 82.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.348 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 48.0 t -54.86 -53.34 56.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.097 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -66.25 -36.11 82.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.387 -177.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 78.7 m -60.73 -50.94 71.47 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 176.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3593 ' ' GLU . . . . . 0.544 ' HA ' ' HD3' ' A' 3596 ' ' LYS . 39.5 tp10 -61.3 -44.45 97.19 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.005 -178.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 37.5 m -61.36 -45.34 94.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.69 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.579 HD13 HD11 ' A' 3657 ' ' LEU . 59.5 tp -60.85 -42.77 98.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.429 178.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.556 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 50.2 mtpt -55.78 -54.16 47.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.853 177.316 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.79 -40.67 88.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.274 -176.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.405 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -89.93 -46.86 8.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -169.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.495 ' HB2' HD12 ' A' 3595 ' ' LEU . 22.3 m-85 -99.56 -50.43 4.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.753 0.311 . . . . 0.0 111.515 -175.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.556 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.0 mm -61.32 -54.39 35.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.717 -176.116 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 45.8 m -59.89 -41.12 90.89 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.267 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.731 ' CE2' HD21 ' A' 3603 ' ' LEU . 0.1 OUTLIER -65.98 -57.03 8.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.906 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.731 HD21 ' CE2' ' A' 3602 ' ' TYR . 0.3 OUTLIER -56.8 -43.61 81.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -177.578 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -69.63 -35.83 75.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.491 -176.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -67.86 -38.89 83.68 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.105 0.478 . . . . 0.0 110.659 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -78.81 -18.04 54.73 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.627 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 49.67 53.7 12.28 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -169.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.428 ' O ' HD11 ' A' 3603 ' ' LEU . . . -133.94 -175.89 3.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.044 -170.105 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.68 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.38 118.32 30.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.411 175.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3610 ' ' GLY . . . . . 0.495 ' N ' HD12 ' A' 3603 ' ' LEU . . . -63.77 104.03 0.79 Allowed Glycine 0 C--O 1.221 -0.707 0 C-N-CA 120.718 -0.753 . . . . 0.0 111.292 177.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.618 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 38.9 mm -90.12 122.45 41.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 121.333 0.587 . . . . 0.0 111.439 -173.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.605 HD12 ' HB3' ' A' 3547 ' ' LEU . 51.1 mt -119.71 111.56 33.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.221 176.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.515 ' HA ' ' O ' ' A' 3624 ' ' TYR . 0.8 OUTLIER -87.46 125.59 34.39 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' 3537 ' ' SER . 5.3 p -130.38 128.72 22.7 Favored Pre-proline 0 C--N 1.315 -0.919 0 CA-C-O 121.02 0.438 . . . . 0.0 111.262 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.634 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 61.7 Cg_endo -75.55 142.4 26.19 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.576 2.184 . . . . 0.0 112.102 175.569 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.437 ' OD1' ' HB2' ' A' 3619 ' ' SER . 2.6 t-20 -103.11 100.89 18.75 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 175.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -35.71 93.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 125.074 3.849 . . . . 0.0 115.316 -168.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 58.5 12.38 13.1 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.523 -0.762 . . . . 0.0 113.651 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3619 ' ' SER . . . . . 0.437 ' HB2' ' OD1' ' A' 3616 ' ' ASN . 15.0 m -106.28 -19.31 13.74 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.741 -0.27 . . . . 0.0 111.307 -174.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 8.6 t30 -157.72 -75.96 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.456 178.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.571 ' HG2' ' HD2' ' A' 3622 ' ' PRO . 0.9 OUTLIER 170.61 168.29 0.2 Allowed Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -172.983 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.634 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 44.1 Cg_endo -75.06 21.73 0.43 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.696 2.264 . . . . 0.0 111.44 165.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3623 ' ' ALA . . . . . 0.499 ' H ' ' C ' ' A' 3621 ' ' GLN . . . -84.36 41.38 0.83 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.961 -176.279 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.515 ' O ' ' HA ' ' A' 3613 ' ' ASN . 86.4 m-85 -120.51 131.83 54.9 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.703 177.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.451 HG13 ' HG3' ' A' 3627 ' ' GLN . 4.1 t -122.23 113.16 37.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.902 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.64 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -94.46 111.34 23.09 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 170.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.475 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 63.0 mt-30 -94.4 110.66 22.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.76 -177.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.585 HG12 HG12 ' A' 3659 ' ' ILE . 32.8 mt -90.87 97.84 7.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.086 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -86.29 141.2 34.63 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.984 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.648 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 60.7 Cg_endo -72.92 169.69 21.52 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.486 2.124 . . . . 0.0 111.361 176.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.03 77.63 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.441 2.094 . . . . 0.0 111.64 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.522 ' O ' ' HG2' ' A' 3636 ' ' GLU . 10.4 p -112.88 162.64 15.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.044 -174.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -45.99 -39.75 9.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.469 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 46.6 t80 -61.52 -52.98 62.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.495 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 56.4 p -66.37 -54.77 20.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.927 -175.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3636 ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' 3632 ' ' CYS . 5.3 mm-40 -59.39 -38.56 80.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.268 -173.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 39.0 t -66.33 -50.11 64.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.752 0.311 . . . . 0.0 110.667 -178.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -65.81 -31.81 72.99 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.42 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.92 -30.98 72.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.956 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.736 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 20.1 m -74.84 -31.46 61.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.323 0.582 . . . . 0.0 109.89 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -79.61 -47.2 15.86 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.932 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.601 HD12 HD21 ' A' 3575 ' ' LEU . 14.7 mt -79.36 -41.8 27.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.139 -173.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -138.2 72.08 46.28 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -174.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -64.71 -19.29 64.47 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.207 1.938 . . . . 0.0 112.014 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3645 ' ' ASP . . . . . 0.483 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 6.6 m-20 -67.84 -60.78 2.25 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.559 -178.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.612 HD13 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -77.15 -26.42 53.03 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.635 -178.27 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.736 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.18 -44.12 71.27 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.231 177.01 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.99 -18.07 63.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.47 -178.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 17.9 m -89.62 -36.76 15.1 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.052 0.453 . . . . 0.0 110.545 177.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.639 ' HA ' HG21 ' A' 3653 ' ' ILE . 5.2 pt -83.11 -10.5 11.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.785 -174.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.4 p -60.06 -25.18 65.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.958 0.408 . . . . 0.0 110.402 176.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -83.93 -41.87 16.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.313 0.577 . . . . 0.0 110.011 173.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.639 HG21 ' HA ' ' A' 3650 ' ' ILE . 0.3 OUTLIER -99.57 34.21 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-O 123.184 1.469 . . . . 0.0 109.094 -172.366 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.447 ' N ' ' HD2' ' A' 3655 ' ' PRO . 23.2 m -34.67 -43.99 0.59 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 113.529 -1.669 . . . . 0.0 114.489 173.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.447 ' HD2' ' N ' ' A' 3654 ' ' SER . 15.8 Cg_endo -60.19 86.05 0.07 OUTLIER 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.656 1.571 . . . . 0.0 111.821 170.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 3.8 p-80 -152.12 178.29 9.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.488 -176.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.579 HD11 HD13 ' A' 3595 ' ' LEU . 42.2 mt -126.9 133.62 50.63 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.474 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 60.1 ttp -97.32 109.99 22.63 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.586 HD12 HD23 ' A' 3524 ' ' LEU . 92.3 mt -100.59 116.74 44.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.28 0.562 . . . . 0.0 111.459 -173.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.714 HG12 ' HD2' ' A' 3573 ' ' TYR . 93.2 t -102.84 113.0 38.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.97 -178.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.64 HG12 ' HG ' ' A' 3626 ' ' LEU . 53.6 mt -90.78 113.13 26.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.294 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.62 127.98 55.91 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.687 0.279 . . . . 0.0 111.07 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 11.7 p -95.85 110.94 23.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.056 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A 3664 ' ' VAL . . . . . 0.48 HG22 ' HB1' ' A' 3623 ' ' ALA . 6.9 m . . . . . 0 C--O 1.248 0.98 0 CA-C-O 119.409 -0.329 . . . . 0.0 111.074 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.558 ' CD1' ' HB2' ' A' 3553 ' ' MET . 20.3 m-85 . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.596 ' CG ' ' H ' ' B' 2520 ' ' THR . 8.6 tt0 55.98 -158.24 0.23 Allowed 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 175.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 2520 ' ' THR . . . . . 0.596 ' H ' ' CG ' ' B' 2519 ' ' GLU . 88.9 m -151.78 123.65 8.03 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 174.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.548 ' HG ' ' OH ' ' A' 3602 ' ' TYR . 0.1 OUTLIER -79.71 -119.1 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -178.328 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.791 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B 2523 ' ' ASP . . . . . 0.444 ' HB2' ' HA ' ' A' 3550 ' ' ALA . 21.7 t70 -110.21 174.33 5.91 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.331 -1.304 . . . . 0.0 112.744 -158.622 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.485 -0.769 . . . . 0.0 109.919 174.241 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.59 HG21 ' HA ' ' A' 3649 ' ' SER . 3.1 m . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 121.451 0.643 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -90.89 153.87 19.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.036 -174.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.652 ' HE2' ' HE1' ' A' 3525 ' ' HIS . 56.5 mtp -63.58 -23.3 67.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.493 176.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.446 ' HA ' HD13 ' A' 3502 ' ' LEU . 45.6 t -62.3 -24.58 35.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.356 -178.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -82.29 -52.78 6.6 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.974 0.416 . . . . 0.0 110.362 176.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.59 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.7 pp -66.25 -37.08 84.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.139 -173.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.637 HD11 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -71.31 -15.76 62.42 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.192 -173.31 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.637 ' N ' HD11 ' A' 3502 ' ' LEU . 23.5 tptm -69.59 -27.06 64.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.273 177.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3504 ' ' LYS . . . . . 0.708 ' HD3' ' CE2' ' A' 3505 ' ' TYR . 32.5 tttt -100.37 -42.02 6.8 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.475 179.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.708 ' CE2' ' HD3' ' A' 3504 ' ' LYS . 0.1 OUTLIER -146.71 106.9 4.02 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.308 177.038 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -86.52 174.01 6.09 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 124.27 3.313 . . . . 0.0 113.886 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.559 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 95.2 mt -72.05 138.79 20.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.118 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3508 ' ' VAL . . . . . 0.405 HG11 ' HB2' ' A' 3526 ' ' PHE . 31.7 m -105.94 -28.17 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.785 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.573 ' HE3' HD13 ' A' 3524 ' ' LEU . 21.1 t90 -153.54 154.75 34.89 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -176.549 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -151.14 121.4 7.27 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.117 0.484 . . . . 0.0 110.126 178.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -171.75 -123.94 0.73 Allowed Glycine 0 N--CA 1.441 -0.997 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.1 mp -141.34 158.76 43.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.1 0.476 . . . . 0.0 111.094 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.438 HD21 ' HB2' ' A' 3547 ' ' LEU . 89.5 mt -112.79 151.46 30.32 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 168.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.656 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.75 125.93 14.66 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.729 0.3 . . . . 0.0 111.575 -178.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.772 HD11 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.02 142.59 38.25 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 173.119 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.811 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.5 OUTLIER 59.88 -94.93 0.05 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.119 0.485 . . . . 0.0 110.157 -171.268 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -136.47 4.78 2.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.192 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.419 ' O ' ' HA ' ' A' 3514 ' ' ALA . 47.8 m-20 -102.53 138.54 39.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.333 -172.79 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.479 HG23 ' HB2' ' A' 3514 ' ' ALA . 27.8 p -127.02 138.04 53.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.943 -179.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -133.83 119.97 19.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.08 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.636 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -71.92 120.19 17.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.049 0.452 . . . . 0.0 110.52 178.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.431 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 33.7 m -132.06 147.76 32.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.857 -175.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -110.95 129.9 55.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.838 172.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.573 HD13 ' HE3' ' A' 3509 ' ' TRP . 0.9 OUTLIER -98.09 110.67 23.21 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.356 0.598 . . . . 0.0 111.886 -175.51 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.652 ' HE1' ' HE2' ' A' 3498 ' ' MET . 54.8 m-70 -84.99 137.11 33.28 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.56 175.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.7 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.7 t80 -67.08 136.38 55.1 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 173.772 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.624 ' CG1' HD23 ' A' 3575 ' ' LEU . 18.8 t -115.11 -55.89 4.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.42 0.629 . . . . 0.0 110.798 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 48.0 t -159.04 171.72 19.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.708 -172.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.42 -150.22 21.14 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.766 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.541 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.7 t-20 -104.87 110.33 22.65 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -61.64 -29.6 70.17 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.544 -176.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3532 ' ' VAL . . . . . 0.532 ' HB ' ' OD1' ' A' 3530 ' ' ASN . 60.9 t -60.55 -33.46 54.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.364 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.526 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 20.4 mt -57.37 -41.46 80.21 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.944 176.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.488 ' HA ' HD11 ' A' 3661 ' ' ILE . . . -66.76 -45.62 77.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.847 0.356 . . . . 0.0 110.462 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -60.99 -33.88 73.93 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.187 -178.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -90.01 -13.91 35.04 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -178.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.45 ' HB2' HD12 ' A' 3626 ' ' LEU . 66.5 p -101.87 -34.72 9.28 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 122.014 -0.429 . . . . 0.0 111.317 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.548 HD11 ' HB2' ' A' 3509 ' ' TRP . 26.9 mt -80.44 114.08 44.57 Favored Pre-proline 0 C--N 1.319 -0.72 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -177.175 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -78.4 152.66 26.88 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.073 2.515 . . . . 0.0 113.431 -169.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 1.3 pt? -154.85 130.9 10.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.567 177.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 42.5 t -148.19 6.53 0.77 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.207 0.527 . . . . 0.0 110.675 -176.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3542 ' ' GLU . . . . . 0.768 ' HG3' ' H ' ' A' 3543 ' ' GLY . 4.3 pt-20 -163.57 -77.28 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.261 -173.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3543 ' ' GLY . . . . . 0.768 ' H ' ' HG3' ' A' 3542 ' ' GLU . . . -131.43 -61.56 0.09 OUTLIER Glycine 0 C--N 1.312 -0.797 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.863 173.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -168.22 85.97 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 111.491 -0.644 . . . . 0.0 111.491 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.56 132.81 36.96 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.885 2.39 . . . . 0.0 112.449 -177.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.602 ' HA ' ' O ' ' A' 3512 ' ' LEU . 37.1 Cg_endo -67.03 126.51 15.3 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.75 2.3 . . . . 0.0 112.801 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.578 ' HB3' HD11 ' A' 3612 ' ' ILE . 37.9 mt -68.82 118.09 11.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.4 178.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.656 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.1 OUTLIER -94.24 133.75 37.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.199 0.523 . . . . 0.0 111.439 -178.116 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.566 ' HA ' HG12 ' A' 3612 ' ' ILE . 23.1 mt -84.49 108.05 16.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-O 122.185 0.993 . . . . 0.0 110.75 -177.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -105.01 -12.31 16.23 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.594 -1.184 . . . . 0.0 111.733 -171.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.612 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 87.5 mt-30 -150.36 177.55 9.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.54 -177.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.723 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.32 141.7 19.64 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 120.693 0.282 . . . . 0.0 111.411 179.495 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.62 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.5 tmm? -109.75 109.03 19.6 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 175.144 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3554 ' ' ARG . . . . . 0.439 ' O ' ' HG3' ' A' 3556 ' ' GLU . 49.1 mtt180 -58.97 110.97 1.14 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.578 ' O ' HD12 ' A' 3555 ' ' LEU . 2.3 pp -68.39 99.18 0.91 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 122.304 1.049 . . . . 0.0 110.56 -173.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.511 ' O ' ' HG ' ' A' 3560 ' ' LEU . 33.9 mt-10 -103.04 157.76 16.77 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.081 176.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.49 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.91 -50.53 70.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.622 0.249 . . . . 0.0 110.908 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 25.6 p -62.19 -39.66 93.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.988 0.423 . . . . 0.0 111.255 178.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.508 ' O ' HG21 ' A' 3563 ' ' VAL . 57.5 mm-40 -65.97 -41.13 91.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.563 -178.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.516 HD23 ' HB2' ' A' 3555 ' ' LEU . 83.7 mt -64.24 -34.78 78.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.779 0.323 . . . . 0.0 110.809 -179.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' 3557 ' ' ALA . 12.1 mm-40 -68.66 -41.66 79.0 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 174.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -57.8 -41.51 94.04 Favored Glycine 0 CA--C 1.517 0.164 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.796 175.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.553 ' O ' ' HG3' ' A' 3567 ' ' MET . 95.5 t -61.7 -51.38 73.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 174.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3564 ' ' ALA . . . . . 0.515 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.63 -24.05 63.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.903 -178.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -61.15 -40.02 92.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.88 0.371 . . . . 0.0 110.536 -179.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 9.9 ptp180 -87.99 -14.69 38.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.998 0.427 . . . . 0.0 110.569 176.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.553 ' HG3' ' O ' ' A' 3563 ' ' VAL . 84.9 mtp -74.68 -19.9 60.08 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.188 -178.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 14.7 t -89.01 3.29 52.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.112 0.482 . . . . 0.0 110.078 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 28.1 t -125.99 91.27 1.75 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.52 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -67.56 110.23 3.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.349 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.541 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 144.19 -38.98 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.561 1.544 . . . . 0.0 108.583 -177.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -82.19 -20.65 37.39 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.782 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.73 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.1 OUTLIER -144.38 165.55 27.59 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.195 176.876 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.572 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 37.2 t -127.8 135.99 50.85 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 170.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.624 HD23 ' CG1' ' A' 3527 ' ' VAL . 14.7 tp -106.46 125.45 51.01 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.549 HD13 HD22 ' A' 3524 ' ' LEU . 78.7 mt -126.57 153.44 45.23 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.203 0.525 . . . . 0.0 110.558 -178.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.619 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.0 108.12 13.92 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.974 -0.751 . . . . 0.0 108.974 -179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.474 ' HB1' HD13 ' A' 3659 ' ' ILE . . . -94.4 121.18 35.67 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.363 0.601 . . . . 0.0 110.449 -177.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.422 ' HG ' HD12 ' A' 3577 ' ' LEU . 68.2 mt -121.04 144.11 38.55 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 114.744 -1.117 . . . . 0.0 110.142 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.09 109.9 0.91 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.215 1.944 . . . . 0.0 111.705 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 18.2 p -95.96 115.72 27.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.208 0.528 . . . . 0.0 110.2 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3582 ' ' GLY . . . . . 0.417 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -102.38 145.87 16.66 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.432 -0.889 . . . . 0.0 112.963 -176.041 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -19.35 63.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.827 0.822 . . . . 0.0 109.689 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.641 ' O ' HG23 ' A' 3588 ' ' VAL . 31.7 t70 -156.97 164.41 38.05 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -57.17 -35.57 69.71 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.021 0.439 . . . . 0.0 110.351 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.53 -41.52 79.8 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.778 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.453 ' HB3' ' H ' ' A' 3584 ' ' ASP . 13.9 t70 -61.94 -40.53 95.87 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.362 177.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.641 HG23 ' O ' ' A' 3584 ' ' ASP . 58.6 t -57.18 -45.04 84.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.271 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.325 178.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 7.1 t -62.31 -53.66 44.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.472 0.653 . . . . 0.0 109.616 -178.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 53.6 m -54.55 -48.88 71.49 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.601 178.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -68.89 -34.28 75.15 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -179.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 87.0 m -61.06 -46.77 89.34 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.851 -0.339 . . . . 0.0 110.115 177.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -64.84 -45.08 87.6 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.979 179.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 70.4 m -53.52 -43.45 68.32 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.736 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.566 HD12 HD11 ' A' 3657 ' ' LEU . 53.4 tp -67.86 -44.09 77.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.719 177.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.58 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 49.6 mtpt -57.98 -57.99 10.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.894 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -63.01 -34.68 78.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.606 -177.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.458 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.84 -47.43 6.15 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -171.46 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.498 ' HB2' HD13 ' A' 3595 ' ' LEU . 17.2 m-85 -99.62 -50.75 3.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.736 0.303 . . . . 0.0 111.529 -174.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.58 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.4 mm -61.5 -50.88 78.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.424 -176.464 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 60.4 m -58.73 -50.01 75.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.518 178.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.715 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.2 OUTLIER -59.75 -58.67 7.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.561 -178.913 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.715 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.4 OUTLIER -54.59 -41.35 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -176.679 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -79.28 -37.37 37.97 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.707 -176.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.29 -39.73 81.99 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.007 0.432 . . . . 0.0 111.185 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3606 ' ' LYS . . . . . 0.429 ' HG3' ' CD1' ' A' 3602 ' ' TYR . 21.6 mmmt -81.51 -15.79 53.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.928 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 52.79 65.42 1.52 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.338 -173.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.588 ' O ' HD11 ' A' 3603 ' ' LEU . . . -146.15 -174.6 4.48 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.916 0.388 . . . . 0.0 111.801 -175.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.723 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -121.81 118.75 29.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.65 177.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3610 ' ' GLY . . . . . 0.53 ' N ' HD13 ' A' 3603 ' ' LEU . . . -63.98 103.15 0.66 Allowed Glycine 0 C--O 1.221 -0.661 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.833 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.612 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 39.7 mm -89.38 120.9 38.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 121.312 0.577 . . . . 0.0 111.092 -174.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.578 HD11 ' HB3' ' A' 3547 ' ' LEU . 32.8 mt -120.52 107.43 20.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.862 176.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.438 ' HA ' ' O ' ' A' 3624 ' ' TYR . 48.9 m-80 -82.54 127.0 32.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.868 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' 3622 ' ' PRO . 35.0 m -122.68 147.45 50.66 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.618 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 72.0 Cg_endo -92.15 135.81 1.55 Allowed 'Trans proline' 0 N--CA 1.444 -1.419 0 C-N-CA 122.517 2.144 . . . . 0.0 111.957 171.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.496 ' HB2' ' CE2' ' A' 3624 ' ' TYR . 9.5 t30 -69.36 113.05 14.03 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.17 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -51.83 114.61 1.68 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 123.661 2.907 . . . . 0.0 112.945 -176.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 108.66 -31.07 8.1 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.382 -179.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 3.4 m -103.05 -22.88 13.72 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.741 0.305 . . . . 0.0 110.524 -178.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 66.9 t30 63.32 18.41 10.98 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.962 179.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3621 ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -90.67 112.15 51.65 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.532 -177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.47 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 89.9 Cg_endo -85.57 23.5 0.83 Allowed 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 123.158 2.572 . . . . 0.0 112.973 -177.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -82.3 48.15 1.24 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.048 0.452 . . . . 0.0 111.094 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.496 ' CE2' ' HB2' ' A' 3616 ' ' ASN . 72.0 m-85 -132.57 133.13 43.32 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.419 178.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.417 HG13 HD13 ' A' 3611 ' ' ILE . 4.5 t -120.5 116.01 48.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.234 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.611 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -97.57 111.71 23.87 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 169.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.42 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 39.1 mt-30 -94.76 111.29 23.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.067 -177.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.591 HG12 HG12 ' A' 3659 ' ' ILE . 45.2 mt -89.61 98.91 8.63 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.294 178.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -88.34 139.5 30.18 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.996 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.54 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 47.5 Cg_endo -68.56 172.95 10.59 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.73 2.287 . . . . 0.0 111.765 178.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.03 37.45 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.778 2.318 . . . . 0.0 112.359 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.465 ' H ' ' C ' ' A' 3630 ' ' PRO . 24.4 p -77.71 163.47 26.14 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.908 -178.873 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -44.67 -40.94 6.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.288 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3634 ' ' PHE . . . . . 0.45 ' HB2' HD11 ' A' 3560 ' ' LEU . 51.2 t80 -52.67 -51.53 59.83 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 34.4 p -70.08 -54.22 14.03 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.126 -173.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -58.81 -37.66 76.87 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -176.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 15.0 t -62.82 -50.71 69.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.094 0.473 . . . . 0.0 110.341 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -67.71 -32.72 73.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.647 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3639 ' ' LEU . . . . . 0.408 ' HB3' HD23 ' A' 3647 ' ' LEU . 79.1 mt -63.94 -39.51 94.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.726 176.327 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3640 ' ' SER . . . . . . . . . . . . . 46.6 m -67.21 -26.76 66.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.265 0.555 . . . . 0.0 110.298 178.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 24.9 ttm180 -80.42 -47.52 14.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.759 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.589 HD12 HD22 ' A' 3575 ' ' LEU . 9.9 mt -86.9 -31.82 20.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.908 -170.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.47 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -150.45 73.24 9.07 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -174.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.24 -16.4 48.37 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.723 2.282 . . . . 0.0 111.958 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3645 ' ' ASP . . . . . 0.605 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 3.9 m-20 -71.92 -55.03 8.22 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.083 -178.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.619 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.5 -30.19 47.03 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.889 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.496 ' HA ' ' CG1' ' A' 3650 ' ' ILE . 3.3 tm? -54.5 -43.2 71.61 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.909 0.385 . . . . 0.0 110.235 177.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3648 ' ' ALA . . . . . 0.432 ' O ' HG21 ' A' 3496 ' ' VAL . . . -63.25 -21.69 66.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.511 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.59 ' HA ' HG21 ' A' 3496 ' ' VAL . 14.7 t -90.1 -31.12 17.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.89 0.376 . . . . 0.0 110.728 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.519 ' HA ' HG23 ' A' 3653 ' ' ILE . 5.0 pt -84.72 -11.4 11.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.768 -175.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 10.7 p -62.78 -20.5 65.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.025 0.441 . . . . 0.0 110.521 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -85.51 -38.05 18.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.254 0.549 . . . . 0.0 109.94 173.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.519 HG23 ' HA ' ' A' 3650 ' ' ILE . 9.1 tp -105.22 41.17 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 122.322 1.058 . . . . 0.0 109.446 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.466 ' N ' ' HD2' ' A' 3655 ' ' PRO . 64.5 m -36.71 -44.51 1.17 Allowed Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 114.26 -1.336 . . . . 0.0 113.837 172.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' 3654 ' ' SER . 12.8 Cg_endo -58.73 88.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.491 1.46 . . . . 0.0 111.744 169.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -157.16 177.67 11.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.343 -177.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.566 HD11 HD12 ' A' 3595 ' ' LEU . 36.3 mt -127.96 139.67 52.44 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.81 -178.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 55.6 ttp -102.48 109.27 20.85 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.591 HG12 HG12 ' A' 3628 ' ' ILE . 79.4 mt -101.21 116.29 44.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-O 121.291 0.567 . . . . 0.0 111.25 -173.163 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.73 HG12 ' HD2' ' A' 3573 ' ' TYR . 71.7 t -101.6 115.71 43.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.928 -177.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.611 HG12 ' HG ' ' A' 3626 ' ' LEU . 64.9 mt -90.84 112.7 25.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -114.31 127.7 55.99 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.898 0.38 . . . . 0.0 111.599 -177.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 53.0 m -84.42 135.12 34.4 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.008 171.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 5.9 p . . . . . 0 C--O 1.249 1.071 0 CA-C-O 119.008 -0.52 . . . . 0.0 109.67 176.155 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.62 ' CD1' ' HB2' ' A' 3553 ' ' MET . 38.3 m-85 . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 111.501 0.186 . . . . 0.0 111.501 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.567 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 4.9 mm-40 52.38 -152.14 0.26 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.551 0.691 . . . . 0.0 110.788 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 76.3 m -153.27 117.19 4.78 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 169.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.639 HD22 ' NH1' ' A' 3552 ' ' ARG . 0.1 OUTLIER -78.95 -129.48 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.746 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.811 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -128.89 -161.39 1.11 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.753 -170.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.416 -178.218 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.459 ' HB ' ' HB3' ' A' 3649 ' ' SER . 35.9 m . . . . . 0 N--CA 1.479 0.985 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 11.9 t70 -105.47 111.08 23.65 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.537 ' HG2' ' HB3' ' A' 3502 ' ' LEU . 55.5 ttp -82.41 -25.06 34.03 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.377 178.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.457 ' HA ' HD12 ' A' 3502 ' ' LEU . 22.3 t -61.11 -24.93 34.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.025 -173.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -80.15 -60.63 2.26 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.745 0.307 . . . . 0.0 110.526 173.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.542 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.1 pp -61.69 -38.63 88.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -174.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.629 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -69.09 -15.99 63.57 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 118.502 0.592 . . . . 0.0 110.872 -172.26 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.629 ' N ' HD13 ' A' 3502 ' ' LEU . 7.7 mmpt? -78.51 -15.61 58.4 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.969 0.414 . . . . 0.0 109.921 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -101.02 -43.69 5.96 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 174.032 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.699 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.7 103.65 3.05 Favored Pre-proline 0 N--CA 1.443 -0.789 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.715 179.786 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -84.0 174.97 7.96 Favored 'Trans proline' 0 CA--C 1.531 0.373 0 C-N-CA 124.381 3.387 . . . . 0.0 113.705 -176.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.425 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 93.0 mt -70.63 139.41 20.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.044 179.241 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 27.4 m -107.17 -26.27 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.357 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.827 ' HD1' HD21 ' A' 3540 ' ' LEU . 61.2 t90 -153.87 145.41 23.21 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -142.42 120.02 11.78 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.98 -128.19 1.01 Allowed Glycine 0 N--CA 1.442 -0.942 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -178.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.595 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.0 mp -139.45 151.84 46.55 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.051 0.453 . . . . 0.0 110.901 179.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.45 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 78.6 mt -105.74 146.03 30.35 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 168.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.648 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -141.47 123.39 15.37 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.755 -176.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.722 HD13 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.15 146.49 40.69 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 173.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.722 ' CD ' HD13 ' A' 3515 ' ' LEU . 1.1 mptm? 59.17 -92.91 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.179 0.592 . . . . 0.0 110.549 -171.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 10.0 m120 -142.08 4.98 1.68 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.187 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -103.02 135.73 44.17 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.384 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.459 HG22 ' HB3' ' A' 3514 ' ' ALA . 7.2 p -116.31 132.25 56.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.867 177.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -124.27 112.86 17.51 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.71 176.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.595 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.78 121.32 17.8 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.433 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -132.64 147.79 31.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.733 0.777 . . . . 0.0 111.911 -175.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -108.31 124.92 51.07 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.787 173.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.759 HD12 ' HE3' ' A' 3509 ' ' TRP . 1.4 mt -94.38 108.77 20.67 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.718 -175.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.486 ' HE1' ' SD ' ' A' 3498 ' ' MET . 83.7 m-70 -85.66 136.93 33.17 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.826 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.699 ' O ' ' HB2' ' A' 3505 ' ' TYR . 68.0 t80 -67.23 137.77 56.43 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.633 ' CG1' HD21 ' A' 3575 ' ' LEU . 23.5 t -114.94 -56.43 4.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.53 0.681 . . . . 0.0 110.565 175.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 57.7 m -163.57 173.06 13.49 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.549 -171.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3529 ' ' GLY . . . . . 0.444 ' HA3' ' HA ' ' A' 3574 ' ' CYS . . . 90.78 -165.0 30.5 Favored Glycine 0 C--O 1.229 -0.2 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.253 177.452 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.567 ' HB2' ' HA ' ' A' 3571 ' ' THR . 49.2 t30 -92.72 108.48 20.02 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.618 0.247 . . . . 0.0 110.539 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 7.8 p30 -61.12 -25.02 66.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.405 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 59.2 t -62.5 -32.87 56.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.947 0.403 . . . . 0.0 110.422 178.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.429 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 24.9 mt -60.52 -39.39 87.62 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.603 177.142 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.459 ' HA ' HD12 ' A' 3661 ' ' ILE . . . -67.69 -40.95 84.32 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-O 120.72 0.295 . . . . 0.0 110.611 -178.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -59.59 -41.63 90.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.856 178.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -89.32 -7.74 54.73 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -174.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.534 ' HB2' HD13 ' A' 3626 ' ' LEU . 66.7 p -104.36 -41.6 5.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.086 0.47 . . . . 0.0 110.876 178.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.576 HD11 ' HB2' ' A' 3509 ' ' TRP . 25.7 mt -80.31 113.64 40.65 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.627 -178.045 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -78.29 134.97 13.14 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.39 2.06 . . . . 0.0 112.415 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.827 HD21 ' HD1' ' A' 3509 ' ' TRP . 2.7 pp -161.59 -177.41 5.9 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.712 -175.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 70.9 m 72.81 -32.85 0.25 Allowed 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.472 0.709 . . . . 0.0 111.803 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3542 ' ' GLU . . . . . 0.442 ' H ' ' C ' ' A' 3540 ' ' LEU . 7.4 pt-20 -109.19 95.03 5.36 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.191 0.52 . . . . 0.0 110.705 177.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 77.07 -45.6 2.29 Favored Glycine 0 CA--C 1.518 0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.978 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 86.46 66.15 1.39 Allowed Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 -175.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.03 141.65 21.22 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.714 2.276 . . . . 0.0 113.152 -173.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.14 134.6 23.45 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.569 2.179 . . . . 0.0 111.613 176.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.574 ' HB3' HD12 ' A' 3612 ' ' ILE . 36.0 mt -68.95 112.11 5.4 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.648 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -95.5 138.61 32.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.033 0.444 . . . . 0.0 110.792 -177.101 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.483 ' HA ' HG12 ' A' 3612 ' ' ILE . 17.9 mt -90.54 107.7 18.77 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 CA-C-O 122.155 0.979 . . . . 0.0 111.145 -174.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -106.99 -5.78 17.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.722 -1.126 . . . . 0.0 111.913 -172.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.638 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 85.0 mt-30 -150.92 175.65 11.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.654 0.264 . . . . 0.0 111.004 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.75 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -149.92 138.9 21.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.049 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.587 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 22.0 ttt -109.77 107.73 17.83 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.276 175.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 34.6 mtm180 -60.09 110.73 1.28 Allowed 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.804 0.335 . . . . 0.0 110.127 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.515 ' HB2' HD21 ' A' 3560 ' ' LEU . 1.8 pp -76.58 97.33 4.36 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.164 0.983 . . . . 0.0 109.863 -176.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.58 ' O ' ' HG ' ' A' 3560 ' ' LEU . 31.4 mt-10 -106.54 168.86 8.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.595 178.078 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.465 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.73 -50.57 68.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.724 0.297 . . . . 0.0 110.62 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 8.2 p -60.94 -40.89 94.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.389 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.563 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 77.8 mm-40 -66.31 -42.69 87.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.103 -177.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' 3556 ' ' GLU . 84.3 mt -60.39 -35.31 75.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.751 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' 3557 ' ' ALA . 15.0 mm-40 -59.89 -46.33 89.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.093 174.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -63.0 -38.76 97.14 Favored Glycine 0 N--CA 1.452 -0.247 0 CA-C-N 115.437 -0.802 . . . . 0.0 112.337 177.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.583 ' O ' ' HG3' ' A' 3567 ' ' MET . 62.1 t -62.02 -54.26 36.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.623 0.249 . . . . 0.0 110.429 177.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -60.87 -29.79 69.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.865 0.364 . . . . 0.0 111.11 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.419 ' O ' HG22 ' A' 3568 ' ' THR . 3.0 tmt_? -59.93 -42.5 94.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.58 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -87.65 -10.34 51.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.197 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.583 ' HG3' ' O ' ' A' 3563 ' ' VAL . 85.9 mtp -85.24 -18.91 32.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.813 0.339 . . . . 0.0 111.413 -179.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3568 ' ' THR . . . . . 0.419 HG22 ' O ' ' A' 3565 ' ' ARG . 12.0 t -82.96 -7.35 59.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.03 0.443 . . . . 0.0 110.529 -178.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 55.2 t -117.65 93.83 2.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-O 121.043 0.449 . . . . 0.0 110.202 178.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -74.67 108.11 7.21 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.567 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.8 m 154.59 -41.66 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.482 1.513 . . . . 0.0 107.669 -172.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -87.01 -26.11 23.92 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.179 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.841 ' HD2' HG11 ' A' 3660 ' ' VAL . 0.1 OUTLIER -132.62 163.56 28.63 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.931 177.472 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.571 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 42.1 t -128.29 136.63 51.26 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 170.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.633 HD21 ' CG1' ' A' 3527 ' ' VAL . 13.3 tp -105.2 126.11 51.73 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.551 HD13 HD23 ' A' 3524 ' ' LEU . 79.4 mt -127.87 153.85 46.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.904 -177.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.753 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -119.56 108.23 14.25 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.415 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.469 ' HB2' HD13 ' A' 3659 ' ' ILE . . . -94.18 120.71 34.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.39 0.614 . . . . 0.0 110.337 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.564 ' HG ' HD11 ' A' 3577 ' ' LEU . 62.5 mt -123.09 145.32 45.69 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.855 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.62 126.73 22.16 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.377 2.051 . . . . 0.0 112.213 179.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 31.5 p -119.14 116.46 26.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.111 0.481 . . . . 0.0 109.871 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.32 146.05 16.39 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.464 -0.874 . . . . 0.0 112.23 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 36.3 mtm180 -59.64 -46.79 87.94 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.444 0.64 . . . . 0.0 109.771 175.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.54 ' O ' HG23 ' A' 3588 ' ' VAL . 4.8 m-20 -132.12 177.06 7.85 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.564 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -55.58 -43.0 75.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.931 0.396 . . . . 0.0 110.558 179.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.09 -46.5 90.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.246 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' A' 3591 ' ' GLN . 15.0 t70 -63.47 -40.88 98.3 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.001 -178.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' 3584 ' ' ASP . 72.1 t -53.85 -47.18 63.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.774 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 94.2 t -60.62 -46.5 95.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.304 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 46.8 t -62.61 -44.94 95.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.404 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3591 ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' 3587 ' ' ASP . 72.1 mm-40 -64.35 -42.0 96.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.762 0.315 . . . . 0.0 110.287 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3592 ' ' THR . . . . . 0.433 ' O ' ' HG3' ' A' 3596 ' ' LYS . 57.8 m -59.63 -53.45 57.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.861 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3593 ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' A' 3596 ' ' LYS . 11.2 pt-20 -65.5 -35.07 79.8 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 121.044 -0.263 . . . . 0.0 111.638 -177.091 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 38.1 m -65.43 -44.17 88.18 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.558 HD13 HD11 ' A' 3657 ' ' LEU . 53.3 tp -63.01 -44.76 95.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.476 178.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.561 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 58.9 mtpt -56.4 -58.18 9.1 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.67 177.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.44 -33.46 75.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.702 -175.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.585 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.62 -46.44 6.63 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -171.792 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.507 ' HB2' HD11 ' A' 3595 ' ' LEU . 19.8 m-85 -99.71 -50.46 4.04 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.79 0.329 . . . . 0.0 111.339 -173.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.561 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 23.4 mm -62.61 -52.6 57.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.032 -176.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 75.3 m -59.49 -45.25 92.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.037 178.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.754 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.0 OUTLIER -66.6 -56.34 11.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.568 -178.14 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.754 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -55.18 -44.3 75.12 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -175.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -73.85 -34.23 64.42 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.685 -176.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.76 -38.4 80.07 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.207 0.527 . . . . 0.0 110.646 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -77.69 -18.64 56.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.445 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 50.72 53.74 12.45 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.484 -169.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.522 ' O ' HD13 ' A' 3603 ' ' LEU . . . -136.26 -175.53 4.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.734 -172.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.75 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.47 121.33 38.24 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.678 177.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3610 ' ' GLY . . . . . 0.535 ' N ' HD12 ' A' 3603 ' ' LEU . . . -63.92 101.53 0.49 Allowed Glycine 0 C--O 1.222 -0.654 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.142 177.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.638 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 29.3 mm -89.97 125.58 42.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.192 0.52 . . . . 0.0 110.928 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.574 HD12 ' HB3' ' A' 3547 ' ' LEU . 41.1 mt -124.63 117.32 50.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.714 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 11.4 m120 -83.34 141.81 31.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.285 -175.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.522 ' O ' ' HB2' ' A' 3624 ' ' TYR . 58.8 t -136.85 125.72 15.2 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.458 178.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.588 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 71.7 Cg_endo -92.39 145.37 2.73 Favored 'Trans proline' 0 N--CA 1.45 -1.077 0 C-N-CA 122.67 2.247 . . . . 0.0 112.362 173.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.5 ' HB2' ' HB3' ' A' 3620 ' ' ASN . 0.9 OUTLIER -117.62 75.89 9.85 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 172.605 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.31 118.71 4.58 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.482 2.788 . . . . 0.0 113.336 -170.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 104.25 -44.1 1.54 Allowed Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.49 176.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 17.2 m -98.66 -31.58 11.85 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.811 0.338 . . . . 0.0 111.334 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3620 ' ' ASN . . . . . 0.5 ' HB3' ' HB2' ' A' 3616 ' ' ASN . 9.9 t-20 -150.6 -174.79 4.87 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -178.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.862 ' HB3' ' HD2' ' A' 3622 ' ' PRO . 27.0 mt-30 -106.44 -178.86 0.64 Allowed Pre-proline 0 C--N 1.318 -0.789 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.862 ' HD2' ' HB3' ' A' 3621 ' ' GLN . 41.1 Cg_endo -68.51 25.18 0.14 Allowed 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.969 2.446 . . . . 0.0 112.281 170.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3623 ' ' ALA . . . . . 0.536 ' H ' ' C ' ' A' 3621 ' ' GLN . . . -80.14 12.33 2.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.682 -173.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.522 ' HB2' ' O ' ' A' 3614 ' ' VAL . 68.0 m-85 -89.5 132.55 34.99 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-O 121.441 0.639 . . . . 0.0 109.6 177.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.542 HG13 ' HG3' ' A' 3627 ' ' GLN . 6.1 t -131.67 113.18 22.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.016 -176.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.639 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -92.31 111.52 23.12 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 171.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.542 ' HG3' HG13 ' A' 3625 ' ' VAL . 50.2 mt-30 -94.33 110.28 22.05 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.757 -177.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.591 HG12 HG12 ' A' 3659 ' ' ILE . 46.8 mt -93.72 97.66 7.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.184 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -87.92 143.64 33.6 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.905 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.453 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 42.9 Cg_endo -67.58 171.07 12.49 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.554 2.169 . . . . 0.0 111.396 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.52 41.66 0.53 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 122.844 2.363 . . . . 0.0 112.816 178.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 15.4 p -75.7 161.7 28.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.919 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3633 ' ' GLU . . . . . 0.42 ' OE2' ' HB2' ' A' 3637 ' ' SER . 4.4 tm-20 -48.85 -44.23 39.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.763 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 21.3 t80 -49.38 -49.85 42.85 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.477 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3635 ' ' SER . . . . . 0.455 ' HA ' ' HE2' ' A' 3658 ' ' MET . 9.5 m -63.56 -54.96 27.89 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.962 -177.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3636 ' ' GLU . . . . . 0.412 ' HA ' HD12 ' A' 3639 ' ' LEU . 3.7 mm-40 -62.5 -34.25 76.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.993 -175.399 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3637 ' ' SER . . . . . 0.42 ' HB2' ' OE2' ' A' 3633 ' ' GLU . 34.2 t -61.22 -50.52 72.76 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.701 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -65.28 -35.46 81.08 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.066 178.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3639 ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' 3636 ' ' GLU . 88.5 mt -63.89 -39.2 93.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.977 177.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3640 ' ' SER . . . . . 1.027 ' HA ' HD21 ' A' 3647 ' ' LEU . 33.6 t -59.72 -37.52 79.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.173 0.511 . . . . 0.0 110.718 177.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 31.6 mtp180 -83.88 -37.66 22.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.28 -179.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.598 HD11 HD23 ' A' 3575 ' ' LEU . 23.5 mt -87.69 -31.13 19.88 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -172.273 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.489 ' HB3' ' CZ ' ' A' 3505 ' ' TYR . . . -154.66 87.34 3.43 Favored Pre-proline 0 N--CA 1.465 0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 111.659 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -74.76 -21.75 16.12 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 122.577 2.185 . . . . 0.0 113.783 -175.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.25 -53.09 10.48 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.394 -0.523 . . . . 0.0 109.842 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.753 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -71.06 -26.44 63.08 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 1.027 HD21 ' HA ' ' A' 3640 ' ' SER . 25.2 tp -53.27 -49.69 66.4 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.353 175.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -58.1 -27.2 63.48 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.016 0.436 . . . . 0.0 110.846 -178.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.459 ' HB3' ' HB ' ' A' 3496 ' ' VAL . 13.6 m -77.85 -45.15 25.14 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.243 178.02 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.576 ' HA ' ' CG2' ' A' 3653 ' ' ILE . 3.8 pt -73.87 -20.13 17.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.82 0.343 . . . . 0.0 111.566 -175.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.5 m -58.09 -28.21 64.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.968 0.413 . . . . 0.0 110.309 175.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -88.51 -34.5 17.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.737 175.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.576 ' CG2' ' HA ' ' A' 3650 ' ' ILE . 9.3 tp -104.99 42.68 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 122.662 1.22 . . . . 0.0 109.014 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.491 ' N ' ' HD2' ' A' 3655 ' ' PRO . 5.4 p -40.1 -38.0 0.95 Allowed Pre-proline 0 CA--C 1.54 0.587 0 CA-C-N 113.61 -1.632 . . . . 0.0 114.216 172.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' 3654 ' ' SER . 19.4 Cg_endo -62.95 78.57 0.11 Allowed 'Trans proline' 0 C--N 1.359 1.113 0 CA-C-N 120.832 1.333 . . . . 0.0 111.415 169.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3656 ' ' HIS . . . . . 0.44 ' HB2' HD22 ' A' 3579 ' ' LEU . 20.5 p80 -148.19 176.17 10.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.061 -177.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.558 HD11 HD13 ' A' 3595 ' ' LEU . 28.0 mt -122.49 152.34 40.41 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.204 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3658 ' ' MET . . . . . 0.455 ' HE2' ' HA ' ' A' 3635 ' ' SER . 13.4 tmm? -115.34 113.24 23.54 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 175.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.591 HG12 HG12 ' A' 3628 ' ' ILE . 80.9 mt -107.55 123.2 62.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.35 0.595 . . . . 0.0 111.971 -170.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.841 HG11 ' HD2' ' A' 3573 ' ' TYR . 78.9 t -108.25 112.7 41.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.644 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.639 HG12 ' HG ' ' A' 3626 ' ' LEU . 58.1 mt -90.57 112.33 24.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.679 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -128.35 143.46 51.01 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.437 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 14.6 m -94.42 107.97 19.91 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 42.8 t . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.455 -0.783 . . . . 0.0 110.193 -178.311 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.527 ' CD1' ' HB2' ' A' 3553 ' ' MET . 64.7 m-85 . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 119.677 -0.201 . . . . 0.0 111.403 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.598 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.8 OUTLIER 56.93 -160.9 0.22 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.526 0.679 . . . . 0.0 111.391 179.233 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 19.2 m -146.53 115.9 7.07 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 166.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.601 ' HG ' ' N ' ' B' 2522 ' ' SEP . 20.3 tp -78.06 -126.76 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.817 -176.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.688 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 26.0 t70 -166.69 -75.43 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.579 174.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 . . . . . 0 C--O 1.252 1.208 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 -177.76 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 3496 ' ' VAL . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.798 0.333 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 17.0 t70 -104.95 113.73 27.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.876 0.369 . . . . 0.0 110.557 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 50.8 mtm -81.63 -21.44 38.24 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.676 -178.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.455 ' HA ' HD13 ' A' 3502 ' ' LEU . 22.7 t -63.46 -24.92 37.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.42 -174.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3500 ' ' GLN . . . . . 0.433 ' HA ' ' OE1' ' A' 3500 ' ' GLN . 14.7 mm-40 -77.17 -55.76 5.15 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.013 0.435 . . . . 0.0 110.859 174.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.558 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp -70.06 -32.99 71.36 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -171.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.595 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.27 -15.55 62.92 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.818 -175.91 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.595 ' N ' HD12 ' A' 3502 ' ' LEU . 18.9 ttpp -65.21 -25.14 67.57 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.563 176.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -105.57 -42.14 5.28 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.745 175.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.664 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.27 108.75 3.19 Favored Pre-proline 0 CA--C 1.536 0.411 0 CA-C-O 121.38 0.609 . . . . 0.0 111.445 -178.624 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 3506 ' ' PRO . . . . . 0.402 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 83.0 Cg_endo -85.49 174.54 6.79 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 124.221 3.281 . . . . 0.0 113.798 -179.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.512 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.6 mt -72.14 134.46 29.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.03 -179.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3508 ' ' VAL . . . . . 0.413 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.5 m -101.25 -31.92 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.504 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.62 ' CB ' HD11 ' A' 3538 ' ' LEU . 34.8 t-105 -149.08 152.53 36.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.745 0.307 . . . . 0.0 110.566 -177.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -145.51 118.18 8.62 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 175.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.75 -134.51 1.72 Allowed Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.576 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -139.76 151.35 45.73 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.296 0.569 . . . . 0.0 111.532 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.451 HD21 ' HB2' ' A' 3547 ' ' LEU . 73.9 mt -105.45 151.97 23.58 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 170.532 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.673 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.91 125.15 12.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.644 0.259 . . . . 0.0 111.572 -178.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.797 HD13 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.97 142.9 40.48 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 173.966 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.797 ' CD ' HD13 ' A' 3515 ' ' LEU . 0.5 OUTLIER 57.47 -93.39 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.496 0.497 . . . . 0.0 109.755 -169.838 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -140.65 7.33 2.1 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.419 ' HB3' ' HB2' ' A' 3598 ' ' ALA . 7.3 m-20 -95.09 144.14 25.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.059 -174.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 17.8 p -132.28 144.12 50.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.963 0.411 . . . . 0.0 111.472 -177.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -139.63 113.82 8.94 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.774 175.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.576 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.29 112.82 9.7 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.41 ' HA ' ' O ' ' A' 3579 ' ' LEU . 26.9 m -125.06 147.78 29.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.623 0.725 . . . . 0.0 112.237 -173.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3523 ' ' GLN . . . . . 0.478 HE21 ' HB3' ' A' 3581 ' ' CYS . 10.6 pt20 -106.03 132.72 51.78 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.604 -1.18 . . . . 0.0 108.577 172.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.543 HD22 HD13 ' A' 3576 ' ' LEU . 1.1 mt -104.66 109.11 20.91 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.437 0.637 . . . . 0.0 111.738 -175.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.512 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 76.3 m-70 -84.42 138.44 32.83 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.106 -0.952 . . . . 0.0 108.638 175.485 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.664 ' O ' ' HB2' ' A' 3505 ' ' TYR . 61.5 t80 -68.05 137.46 55.05 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 174.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.601 ' CG1' HD21 ' A' 3575 ' ' LEU . 19.8 t -114.8 -56.76 4.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.281 0.562 . . . . 0.0 111.1 177.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 22.7 t -160.57 171.5 18.84 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.422 -173.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.45 -148.02 20.36 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.719 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.58 ' HB2' ' HA ' ' A' 3571 ' ' THR . 38.1 t30 -108.63 116.77 32.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.744 0.307 . . . . 0.0 110.975 -178.341 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -68.67 -23.53 64.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.167 -176.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3532 ' ' VAL . . . . . 0.449 ' O ' ' HG2' ' A' 3536 ' ' ARG . 90.0 t -59.71 -36.29 64.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.876 0.37 . . . . 0.0 110.313 177.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.484 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 59.1 mt -59.33 -37.42 77.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.874 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.423 ' HB3' ' CD1' ' A' 3538 ' ' LEU . . . -69.47 -41.4 76.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.619 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 15.6 t60 -60.39 -36.26 77.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.151 -177.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3536 ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' 3532 ' ' VAL . 12.5 ptp180 -89.13 -26.66 21.21 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.2 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.607 ' O ' HG11 ' A' 3614 ' ' VAL . 72.8 p -86.72 -38.94 16.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.119 0.485 . . . . 0.0 110.904 -178.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.62 HD11 ' CB ' ' A' 3509 ' ' TRP . 22.0 mt -81.51 123.57 80.83 Favored Pre-proline 0 C--N 1.316 -0.855 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3539 ' ' PRO . . . . . 0.858 ' HB2' ' HD2' ' A' 3545 ' ' PRO . 6.2 Cg_endo -72.44 120.08 6.52 Favored 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 121.801 1.667 . . . . 0.0 111.383 -178.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' 3538 ' ' LEU . 1.6 pp -156.45 -178.21 7.16 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.34 -172.798 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 70.5 m 71.1 -0.23 3.15 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.554 0.742 . . . . 0.0 112.455 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -172.84 97.73 0.13 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.384 0.612 . . . . 0.0 110.782 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 83.98 -60.96 4.8 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.409 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 72.41 67.71 1.77 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 121.177 -0.535 . . . . 0.0 112.164 -178.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3545 ' ' PRO . . . . . 0.858 ' HD2' ' HB2' ' A' 3539 ' ' PRO . 17.5 Cg_exo -65.99 154.8 72.54 Favored 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.809 2.339 . . . . 0.0 112.395 -178.477 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.58 145.83 77.51 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.499 2.132 . . . . 0.0 112.186 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.576 ' HB3' HD11 ' A' 3612 ' ' ILE . 49.9 mt -81.82 112.74 19.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.261 177.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' A' 3514 ' ' ALA . 21.7 ptt85 -90.34 141.51 28.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.871 0.367 . . . . 0.0 111.196 -177.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.532 ' CG2' HD11 ' B' 2521 ' ' LEU . 20.2 mt -95.02 107.14 19.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.865 0.841 . . . . 0.0 110.636 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.425 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -110.83 -4.15 15.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.594 -172.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.649 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 52.9 mt-30 -150.97 176.49 11.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.955 -0.111 . . . . 0.0 111.022 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.762 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -160.38 140.13 11.13 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -177.78 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.571 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -112.4 125.21 53.96 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.72 -0.218 . . . . 0.0 110.641 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3554 ' ' ARG . . . . . 0.419 HH11 ' HD2' ' A' 3554 ' ' ARG . 13.6 mmt85 -68.82 110.3 4.29 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.589 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -72.35 98.57 2.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 122.293 1.045 . . . . 0.0 110.318 -175.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.567 ' O ' ' HG ' ' A' 3560 ' ' LEU . 37.8 mt-10 -106.24 156.88 18.02 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.492 177.806 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.489 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -53.96 -50.24 66.95 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.125 0.266 . . . . 0.0 111.295 -177.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 18.7 p -63.98 -42.54 97.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.905 0.383 . . . . 0.0 111.246 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.494 ' O ' HG21 ' A' 3563 ' ' VAL . 80.9 mm-40 -61.37 -42.46 98.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.078 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' 3556 ' ' GLU . 94.0 mt -65.18 -31.9 73.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.199 -178.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' 3557 ' ' ALA . 22.4 mm-40 -66.78 -45.27 79.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.214 0.53 . . . . 0.0 109.636 175.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -57.66 -41.75 93.89 Favored Glycine 0 CA--C 1.519 0.291 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.036 174.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.575 ' O ' ' HG3' ' A' 3567 ' ' MET . 97.1 t -61.94 -46.75 95.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.843 0.354 . . . . 0.0 110.207 177.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -62.61 -25.48 68.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.541 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.454 ' O ' HG22 ' A' 3568 ' ' THR . 41.5 ttm105 -63.61 -34.58 78.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.64 178.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3566 ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' 3563 ' ' VAL . 10.5 ptp180 -86.45 -18.97 30.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.19 0.519 . . . . 0.0 109.889 176.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.575 ' HG3' ' O ' ' A' 3563 ' ' VAL . 90.0 mtp -75.44 -22.29 57.47 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.917 -177.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3568 ' ' THR . . . . . 0.454 HG22 ' O ' ' A' 3565 ' ' ARG . 6.1 t -80.22 -8.65 59.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.126 0.489 . . . . 0.0 110.25 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.4 t -113.16 89.65 1.34 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.354 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.91 110.45 6.42 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.072 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.58 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 3.3 m 147.48 -39.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.894 1.677 . . . . 0.0 107.819 -177.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.02 -30.79 44.4 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.665 -179.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.79 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -133.43 167.14 20.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.068 178.464 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.595 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 35.2 t -128.11 137.06 51.97 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 172.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.601 HD21 ' CG1' ' A' 3527 ' ' VAL . 14.1 tp -106.43 125.52 51.1 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.543 HD13 HD22 ' A' 3524 ' ' LEU . 80.3 mt -128.23 155.22 44.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.177 0.513 . . . . 0.0 110.899 -177.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.733 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.4 OUTLIER -122.12 108.53 13.45 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.407 179.367 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.453 ' HB3' HD11 ' A' 3659 ' ' ILE . . . -95.0 125.91 39.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.289 0.566 . . . . 0.0 110.706 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.486 HD22 ' HB2' ' A' 3656 ' ' HIS . 75.3 mt -125.24 144.44 47.48 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.242 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -61.87 112.22 1.44 Allowed 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.347 2.031 . . . . 0.0 111.874 178.137 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3581 ' ' CYS . . . . . 0.478 ' HB3' HE21 ' A' 3523 ' ' GLN . 26.4 p -104.7 120.61 41.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.868 0.366 . . . . 0.0 110.345 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3582 ' ' GLY . . . . . 0.404 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.07 145.17 16.19 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.849 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -67.13 -38.55 85.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.743 0.782 . . . . 0.0 109.465 176.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.567 ' O ' HG21 ' A' 3588 ' ' VAL . 29.1 t70 -136.73 169.68 17.34 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.524 -1.216 . . . . 0.0 107.808 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -56.65 -37.1 70.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.287 0.494 . . . . 0.0 110.512 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -60.72 -46.55 89.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.285 0.564 . . . . 0.0 109.509 176.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 23.4 t70 -64.37 -42.54 96.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.785 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.567 HG21 ' O ' ' A' 3584 ' ' ASP . 89.6 t -54.76 -47.49 74.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.776 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 87.8 t -58.95 -49.44 83.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.385 178.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 23.0 t -60.07 -48.91 79.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.765 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -63.37 -37.83 88.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.859 -0.155 . . . . 0.0 111.413 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 66.5 m -61.51 -52.0 66.28 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.068 0.461 . . . . 0.0 110.484 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3593 ' ' GLU . . . . . 0.495 ' HA ' ' HG2' ' A' 3596 ' ' LYS . 26.9 mt-10 -68.55 -38.66 80.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.886 -179.293 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 18.3 t -58.03 -49.65 76.14 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.136 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.579 HD12 HD12 ' A' 3657 ' ' LEU . 57.8 tp -62.5 -46.69 87.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.327 -178.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.811 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 65.7 pttt -70.35 -33.85 71.95 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.143 -175.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -77.82 -37.34 48.84 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 121.041 -0.264 . . . . 0.0 111.709 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.419 ' HB2' ' HB3' ' A' 3518 ' ' ASP . . . -91.96 -46.95 7.55 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -172.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.5 ' HB2' HD11 ' A' 3595 ' ' LEU . 14.8 m-85 -98.7 -49.74 4.49 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.637 0.256 . . . . 0.0 111.294 -174.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.811 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 25.1 mm -60.55 -55.31 25.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.708 -178.367 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 64.2 m -57.63 -38.46 75.03 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.208 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.773 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.1 OUTLIER -68.84 -57.11 6.02 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.866 178.522 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.773 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.22 -41.91 76.4 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.569 0.223 . . . . 0.0 111.55 -177.212 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -72.05 -36.93 69.76 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.703 -177.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.33 -36.95 80.04 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.053 0.454 . . . . 0.0 110.758 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -79.61 -18.31 51.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.87 178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3607 ' ' GLN . . . . . 0.528 ' O ' ' HG ' ' A' 3555 ' ' LEU . 22.7 mt-30 51.92 48.31 23.02 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -171.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.492 ' O ' HD11 ' A' 3603 ' ' LEU . . . -130.24 -175.93 3.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.295 -171.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.762 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.71 117.73 28.24 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.499 175.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3610 ' ' GLY . . . . . 0.438 ' N ' HD12 ' A' 3603 ' ' LEU . . . -66.21 105.4 1.27 Allowed Glycine 0 C--O 1.222 -0.641 0 C-N-CA 120.837 -0.696 . . . . 0.0 111.896 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.649 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 35.4 mm -89.69 125.91 42.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.223 0.535 . . . . 0.0 111.22 -175.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.576 HD11 ' HB3' ' A' 3547 ' ' LEU . 28.1 mt -121.23 114.72 44.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.302 178.001 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.525 ' HA ' ' O ' ' A' 3624 ' ' TYR . 12.9 m120 -88.74 127.96 35.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.359 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.607 HG11 ' O ' ' A' 3537 ' ' SER . 4.8 t -126.37 135.32 27.02 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.187 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.501 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 79.6 Cg_endo -84.39 136.96 6.78 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 122.103 1.869 . . . . 0.0 111.687 168.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.753 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 26.1 t-20 -66.97 126.91 93.22 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.378 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3617 ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' 3616 ' ' ASN . 32.0 Cg_exo -58.62 102.97 0.15 Allowed 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.974 2.449 . . . . 0.0 112.419 -178.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 109.34 -29.28 9.74 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.882 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3619 ' ' SER . . . . . 0.668 ' HB3' ' HB3' ' A' 3616 ' ' ASN . 29.5 t -94.97 -30.02 14.34 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.928 0.394 . . . . 0.0 110.135 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 63.2 t30 69.68 7.0 6.0 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.304 178.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3621 ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -78.73 115.1 49.27 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.41 177.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.501 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 71.7 Cg_endo -87.85 23.97 0.75 Allowed 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 123.355 2.704 . . . . 0.0 112.618 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -78.95 44.04 0.54 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.363 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.753 ' HE2' ' HB2' ' A' 3616 ' ' ASN . 72.7 m-85 -123.86 133.56 53.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.044 0.449 . . . . 0.0 110.506 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.412 HG13 HD11 ' A' 3611 ' ' ILE . 4.3 t -126.67 114.07 36.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.851 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.6 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -98.42 114.88 27.4 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 169.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.508 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 65.4 mt-30 -94.5 110.92 22.68 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.59 HG12 HG12 ' A' 3659 ' ' ILE . 39.2 mt -92.38 98.7 8.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.279 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -88.55 142.59 31.2 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.917 177.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.5 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 48.2 Cg_endo -68.98 172.96 10.96 Favored 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 122.578 2.185 . . . . 0.0 111.308 176.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.35 45.23 0.51 Allowed 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.078 2.519 . . . . 0.0 112.276 176.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.7 p -84.39 163.35 19.57 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.982 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -42.62 -49.85 5.47 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 123.959 0.787 . . . . 0.0 112.02 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3634 ' ' PHE . . . . . 0.503 ' HB2' HD12 ' A' 3560 ' ' LEU . 38.6 t80 -50.82 -48.12 59.82 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 123.339 0.399 . . . . 0.0 111.487 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3635 ' ' SER . . . . . 0.418 ' HA ' ' HE1' ' A' 3658 ' ' MET . 9.7 m -68.15 -58.43 4.47 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.629 -176.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -60.93 -41.15 95.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.427 -173.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 9.0 t -66.19 -44.97 82.42 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 120.927 0.394 . . . . 0.0 110.243 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 19.7 m80 -68.87 -30.13 68.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.629 178.726 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 68.9 mt -66.01 -40.66 91.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.846 175.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.457 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 32.7 t -67.1 -25.55 66.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.15 0.5 . . . . 0.0 110.181 177.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -83.86 -38.6 20.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.189 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.582 HD13 HD22 ' A' 3575 ' ' LEU . 12.7 mt -94.91 -31.4 13.69 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -172.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.421 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -149.08 75.27 9.82 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -175.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -67.91 -18.75 46.77 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.788 2.325 . . . . 0.0 111.782 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3645 ' ' ASP . . . . . 0.537 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 2.7 m-20 -71.11 -49.95 38.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.196 -177.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.733 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -83.05 -29.11 29.1 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.444 178.818 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.457 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.35 -43.83 71.64 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.97 0.414 . . . . 0.0 110.45 179.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -67.14 -18.46 65.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.233 -0.44 . . . . 0.0 112.098 -176.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 89.1 p -91.49 -26.19 18.92 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.227 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.556 ' HA ' HG22 ' A' 3653 ' ' ILE . 7.1 pt -88.07 -10.44 10.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.558 -177.03 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.2 p -58.58 -23.93 59.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.875 175.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 5.3 t30 -85.9 -36.51 19.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.094 0.473 . . . . 0.0 110.206 175.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.556 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.4 tp -104.47 38.95 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 122.379 1.085 . . . . 0.0 109.789 -178.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.443 ' N ' ' HD2' ' A' 3655 ' ' PRO . 50.7 m -36.78 -42.24 0.81 Allowed Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 114.157 -1.383 . . . . 0.0 113.947 170.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.443 ' HD2' ' N ' ' A' 3654 ' ' SER . 12.9 Cg_endo -59.75 77.44 0.06 OUTLIER 'Trans proline' 0 C--N 1.357 1.008 0 C-N-CA 121.533 1.489 . . . . 0.0 111.517 168.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3656 ' ' HIS . . . . . 0.486 ' HB2' HD22 ' A' 3579 ' ' LEU . 22.5 p80 -147.69 174.89 11.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.776 -177.165 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.579 HD12 HD12 ' A' 3595 ' ' LEU . 42.9 mt -120.76 149.85 41.91 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.525 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3658 ' ' MET . . . . . 0.418 ' HE1' ' HA ' ' A' 3635 ' ' SER . 16.2 tmm? -113.98 114.54 26.31 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 174.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.59 HG12 HG12 ' A' 3628 ' ' ILE . 74.8 mt -108.38 121.22 61.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.169 0.509 . . . . 0.0 111.811 -170.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.79 HG13 ' HD2' ' A' 3573 ' ' TYR . 76.1 t -105.34 114.77 45.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.918 -178.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.6 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.5 mt -91.15 118.45 36.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.314 178.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.5 127.66 55.77 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.654 0.264 . . . . 0.0 110.615 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A 3663 ' ' SER . . . . . 0.455 ' HB2' HD21 ' A' 3533 ' ' LEU . 33.6 t -91.73 122.35 34.2 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.41 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 C--O 1.251 1.154 0 CA-C-O 117.337 -1.316 . . . . 0.0 112.693 178.221 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.571 ' CD1' ' HB2' ' A' 3553 ' ' MET . 8.9 m-85 . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 111.619 0.229 . . . . 0.0 111.619 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.604 ' O ' ' HG2' ' A' 3551 ' ' GLN . 4.5 tt0 58.44 -155.81 0.34 Allowed 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 2520 ' ' THR . . . . . 0.595 ' H ' ' CG ' ' B' 2519 ' ' GLU . 58.5 m -155.07 121.87 5.42 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 175.248 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.59 HD13 ' H ' ' B' 2522 ' ' SEP . 0.2 OUTLIER -84.53 -130.12 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.252 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.639 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -162.4 -156.28 0.4 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 44.1 tt0 . . . . . 0 C--O 1.247 0.941 0 CA-C-O 118.803 -0.617 . . . . 0.0 110.463 -179.953 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 3496 ' ' VAL . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 121.811 0.815 . . . . 0.0 110.933 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A 3497 ' ' ASP . . . . . 0.411 ' OD1' HG21 ' A' 3499 ' ' VAL . 10.8 t70 -87.38 154.57 20.56 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.062 -178.161 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.521 ' O ' HD11 ' A' 3502 ' ' LEU . 38.2 ttp -62.3 -26.53 68.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.788 -0.187 . . . . 0.0 110.772 -179.154 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.462 ' HA ' HD11 ' A' 3502 ' ' LEU . 97.8 t -56.24 -25.0 19.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 121.183 0.516 . . . . 0.0 110.815 177.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -79.6 -58.76 3.03 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.264 174.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.563 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp -66.55 -36.93 83.87 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -172.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.646 HD12 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -69.4 -15.32 63.27 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.131 0.491 . . . . 0.0 110.163 -172.582 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.646 ' N ' HD12 ' A' 3502 ' ' LEU . 21.6 tptm -77.9 -25.92 48.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3504 ' ' LYS . . . . . 0.487 ' HG3' ' OD2' ' A' 3645 ' ' ASP . 31.5 mmtp -89.44 -43.14 11.07 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.706 175.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.725 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -153.74 104.17 2.51 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.18 179.598 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -84.01 174.12 8.58 Favored 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 124.085 3.19 . . . . 0.0 114.091 -174.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.503 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.8 mt -71.39 135.69 27.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.115 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 27.7 m -104.75 -29.57 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.292 -179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.677 ' HE3' HD12 ' A' 3524 ' ' LEU . 45.4 t90 -150.02 155.36 39.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -150.9 127.12 10.57 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . 177.93 -125.81 1.03 Allowed Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.539 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.646 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.3 mp -141.01 158.54 43.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.089 0.471 . . . . 0.0 111.098 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.495 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 79.7 mt -112.05 152.55 28.07 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 169.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.609 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.85 123.31 12.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.802 0.334 . . . . 0.0 111.836 -177.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.817 HD13 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.42 142.12 39.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 172.957 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.817 ' CD ' HD13 ' A' 3515 ' ' LEU . 0.5 OUTLIER 60.4 -91.6 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 122.788 0.435 . . . . 0.0 110.034 -171.385 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 45.7 m-80 -142.98 7.04 1.6 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.16 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -99.73 138.04 37.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.714 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.447 HG21 ' HB1' ' A' 3514 ' ' ALA . 15.3 p -128.86 127.82 42.63 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.748 -177.237 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -119.96 120.88 37.64 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.745 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.605 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -75.48 117.05 16.86 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.414 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 30.2 m -129.95 148.36 33.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.417 0.627 . . . . 0.0 111.974 -174.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -110.29 128.71 55.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.259 -0.882 . . . . 0.0 108.872 172.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.677 HD12 ' HE3' ' A' 3509 ' ' TRP . 1.5 mt -95.6 113.02 24.62 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.186 -174.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.515 ' CE1' HD11 ' A' 3579 ' ' LEU . 70.2 m80 -88.45 141.79 28.25 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.785 175.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.725 ' O ' ' HB2' ' A' 3505 ' ' TYR . 64.3 t80 -71.77 139.71 49.15 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 172.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.634 ' CG1' HD22 ' A' 3575 ' ' LEU . 21.4 t -115.23 -57.59 3.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.461 0.648 . . . . 0.0 110.719 176.081 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.517 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 68.9 m -159.42 171.77 19.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.175 -171.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.57 -149.06 20.33 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.792 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.485 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.4 t-20 -104.64 110.55 22.91 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.211 0.204 . . . . 0.0 110.664 -177.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.9 p30 -63.17 -30.93 71.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.538 -176.555 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 19.1 t -59.92 -33.47 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.88 0.372 . . . . 0.0 110.028 -179.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.442 ' HB2' ' O ' ' A' 3530 ' ' ASN . 17.8 mt -56.71 -48.33 77.96 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.235 175.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.437 ' HA ' HD11 ' A' 3661 ' ' ILE . . . -65.13 -38.23 89.95 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.413 0.625 . . . . 0.0 110.23 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -62.52 -40.21 96.03 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.27 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -89.38 -10.01 48.19 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.416 ' HB2' HD13 ' A' 3626 ' ' LEU . 29.8 p -98.9 -41.82 7.43 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 122.015 -0.428 . . . . 0.0 111.506 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.558 HD11 ' HB2' ' A' 3509 ' ' TRP . 29.8 mt -78.84 111.27 18.4 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-O 121.142 0.496 . . . . 0.0 110.063 -173.533 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.21 152.54 45.14 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.078 2.519 . . . . 0.0 112.474 -172.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.498 ' O ' HD11 ' A' 3540 ' ' LEU . 2.2 pp -169.54 138.6 1.95 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.728 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 31.8 t -140.51 -44.32 0.4 Allowed 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -136.96 95.99 3.22 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.807 177.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 78.25 -105.28 2.14 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.924 -175.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -155.73 103.33 0.23 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.089 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3545 ' ' PRO . . . . . 0.409 ' CD ' ' HA ' ' A' 3540 ' ' LEU . 47.4 Cg_endo -68.88 138.37 40.5 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.843 2.362 . . . . 0.0 112.1 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.646 ' HA ' ' O ' ' A' 3512 ' ' LEU . 33.8 Cg_endo -64.27 121.71 9.43 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.414 2.076 . . . . 0.0 112.52 -177.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.586 ' HB3' HD12 ' A' 3612 ' ' ILE . 24.4 mt -69.05 115.42 8.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.795 174.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.624 ' HD2' ' OD2' ' B' 2523 ' ' ASP . 20.0 ptt180 -90.31 138.64 31.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.06 -176.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.493 ' CG2' HD12 ' B' 2521 ' ' LEU . 20.8 mt -95.26 106.96 18.87 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 CA-C-O 122.152 0.977 . . . . 0.0 110.865 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.463 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.38 -2.05 14.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.581 -1.191 . . . . 0.0 111.695 -173.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.687 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 16.1 mt-30 -151.13 174.44 13.21 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.459 0.171 . . . . 0.0 111.331 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.742 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -157.0 136.43 12.15 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.357 -177.874 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.565 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 11.7 tmm? -110.03 121.11 44.48 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.288 177.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3554 ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' 3554 ' ' ARG . 9.3 mmt180 -63.3 111.35 2.23 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.529 ' O ' HD12 ' A' 3555 ' ' LEU . 2.9 pp -71.84 97.32 1.79 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 122.472 1.13 . . . . 0.0 108.683 178.675 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' 3560 ' ' LEU . 6.0 mm-40 -103.9 163.86 12.08 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.498 -177.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.506 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -58.45 -45.89 87.66 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.224 0.328 . . . . 0.0 110.18 176.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 44.8 p -66.07 -41.86 90.17 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.107 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.562 ' O ' HG22 ' A' 3563 ' ' VAL . 15.4 mm100 -63.45 -49.71 72.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.13 -179.164 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.521 HD22 ' HB2' ' A' 3555 ' ' LEU . 79.7 mt -59.69 -37.51 79.02 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.512 -176.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' 3557 ' ' ALA . 7.4 mm-40 -56.58 -53.35 58.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.961 0.41 . . . . 0.0 110.06 175.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -60.89 -41.11 99.15 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.199 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.562 HG22 ' O ' ' A' 3559 ' ' GLN . 91.9 t -60.52 -52.78 57.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.448 0.166 . . . . 0.0 110.635 178.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.5 91.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.787 0.327 . . . . 0.0 111.293 -178.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.534 ' O ' HG23 ' A' 3568 ' ' THR . 98.1 mtt180 -68.05 -27.26 66.37 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.595 -177.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -88.42 -20.08 25.71 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.229 -0.588 . . . . 0.0 110.503 172.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.476 ' HE1' HD12 ' A' 3575 ' ' LEU . 76.8 mtp -74.69 -21.5 59.36 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.739 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3568 ' ' THR . . . . . 0.534 HG23 ' O ' ' A' 3565 ' ' ARG . 5.6 t -74.88 -7.32 53.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.113 0.483 . . . . 0.0 110.253 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.7 t -105.34 87.93 1.13 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.556 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.149 177.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -73.53 108.16 6.22 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.485 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.4 m 155.04 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.536 1.535 . . . . 0.0 107.811 -174.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -84.69 -24.96 28.73 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.934 -178.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.676 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.1 OUTLIER -130.16 161.52 30.93 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.053 179.616 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.598 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 47.8 t -124.84 135.83 53.26 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 171.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.634 HD22 ' CG1' ' A' 3527 ' ' VAL . 13.3 tp -105.61 125.55 51.11 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.532 HD13 HD23 ' A' 3524 ' ' LEU . 76.8 mt -125.57 153.44 43.69 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.143 0.497 . . . . 0.0 110.951 -177.306 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.599 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -121.94 106.39 11.19 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.47 ' HB2' HD11 ' A' 3659 ' ' ILE . . . -94.44 123.99 38.19 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.365 0.602 . . . . 0.0 110.24 -177.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.515 HD11 ' CE1' ' A' 3525 ' ' HIS . 79.1 mt -125.48 143.33 44.41 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.162 -178.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -61.36 113.33 1.73 Allowed 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.406 2.07 . . . . 0.0 111.637 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 28.0 p -100.89 111.69 23.96 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.096 0.474 . . . . 0.0 110.431 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.07 146.08 16.23 Favored Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.727 177.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 29.4 ttt180 -60.61 -35.82 77.07 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-O 121.344 0.592 . . . . 0.0 110.92 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.565 ' O ' HG21 ' A' 3588 ' ' VAL . 28.1 t70 -140.44 169.54 17.47 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -53.59 -39.85 65.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 118.003 0.365 . . . . 0.0 111.181 -178.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -63.39 -44.6 94.24 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.202 0.525 . . . . 0.0 110.603 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 12.6 t70 -63.34 -39.73 95.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.908 -179.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.565 HG21 ' O ' ' A' 3584 ' ' ASP . 84.9 t -60.08 -41.48 86.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.945 178.62 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 4.9 t -62.59 -50.34 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 CA-C-O 121.555 0.693 . . . . 0.0 109.744 -178.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 37.1 m -59.84 -41.76 92.11 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 114.391 -1.277 . . . . 0.0 111.555 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -68.63 -38.23 80.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.48 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3592 ' ' THR . . . . . 0.443 ' O ' ' HG3' ' A' 3596 ' ' LYS . 86.6 m -58.55 -54.74 43.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.933 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -65.24 -33.4 75.9 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.965 -0.294 . . . . 0.0 111.2 -177.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 66.7 m -63.8 -45.94 87.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.421 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.578 HD12 HD12 ' A' 3657 ' ' LEU . 57.6 tp -62.95 -40.7 98.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.471 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.511 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 55.1 mtpt -58.74 -59.43 5.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.888 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.63 -29.53 69.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -174.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -95.64 -47.68 6.11 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -173.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.498 ' HB2' HD13 ' A' 3595 ' ' LEU . 23.5 m-85 -100.72 -50.26 3.92 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -174.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.511 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.4 mm -62.35 -58.59 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.893 -175.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 32.5 m -59.63 -31.61 69.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.237 -178.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.813 ' CE2' HD23 ' A' 3603 ' ' LEU . 0.1 OUTLIER -72.62 -58.61 3.23 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.812 177.752 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.813 HD23 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.37 -42.54 78.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.567 0.223 . . . . 0.0 111.56 -178.161 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -69.85 -38.15 76.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.6 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.22 -40.17 74.7 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.009 0.433 . . . . 0.0 110.499 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -73.98 -19.05 60.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.001 178.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3607 ' ' GLN . . . . . 0.489 ' O ' ' HG ' ' A' 3555 ' ' LEU . 23.5 mt-30 48.72 52.46 13.93 Favored 'General case' 0 C--O 1.23 0.068 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 -169.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.431 ' O ' HD13 ' A' 3603 ' ' LEU . . . -130.96 -175.96 3.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.978 -0.556 . . . . 0.0 112.197 -173.055 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.742 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.92 117.47 27.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.306 175.361 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.39 103.73 0.79 Allowed Glycine 0 C--O 1.222 -0.653 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.338 178.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.687 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.4 mm -89.28 120.23 37.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.207 0.527 . . . . 0.0 111.377 -173.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.586 HD12 ' HB3' ' A' 3547 ' ' LEU . 30.5 mt -122.53 105.29 15.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.825 175.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.521 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.8 m120 -83.65 125.06 31.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.866 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 34.5 m -117.15 140.13 26.76 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.443 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.633 ' HA ' ' O ' ' A' 3621 ' ' GLN . 93.2 Cg_endo -92.99 146.33 2.44 Favored 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 122.558 2.172 . . . . 0.0 112.137 172.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.657 ' HB2' ' HB2' ' A' 3619 ' ' SER . 19.7 m120 -59.61 124.63 76.77 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 172.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.64 109.83 0.47 Allowed 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.891 2.394 . . . . 0.0 112.63 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 97.97 -21.2 47.31 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.258 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3619 ' ' SER . . . . . 0.657 ' HB2' ' HB2' ' A' 3616 ' ' ASN . 14.5 m -99.41 -25.43 14.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.761 0.315 . . . . 0.0 110.678 -178.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3620 ' ' ASN . . . . . 0.403 ' O ' ' HD3' ' A' 3622 ' ' PRO . 6.0 m-20 63.29 29.26 15.84 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.823 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.633 ' O ' ' HA ' ' A' 3615 ' ' PRO . 75.8 mm-40 -93.68 105.9 18.7 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 176.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.403 ' HD3' ' O ' ' A' 3620 ' ' ASN . 93.0 Cg_endo -87.55 24.83 0.69 Allowed 'Trans proline' 0 N--CA 1.463 -0.305 0 C-N-CA 123.458 2.772 . . . . 0.0 113.164 -174.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -76.41 23.36 0.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -174.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.521 ' O ' ' HA ' ' A' 3613 ' ' ASN . 79.3 m-85 -118.04 133.02 56.31 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 120.829 0.347 . . . . 0.0 110.492 -179.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.488 HG12 HG21 ' A' 3611 ' ' ILE . 9.9 t -122.74 115.75 46.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.237 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.644 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -95.55 110.03 22.17 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 170.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.485 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 61.5 mt-30 -94.5 110.74 22.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.692 -177.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.585 HG12 HG12 ' A' 3659 ' ' ILE . 31.6 mt -89.75 98.27 7.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.126 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -87.54 144.5 35.61 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.875 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.644 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 58.8 Cg_endo -71.7 170.18 19.3 Favored 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.576 2.184 . . . . 0.0 111.404 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3631 ' ' PRO . . . . . 0.416 ' HD3' ' O ' ' A' 3656 ' ' HIS . 36.9 Cg_endo -67.96 77.61 0.59 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.362 2.041 . . . . 0.0 110.969 174.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.543 ' O ' ' HG2' ' A' 3636 ' ' GLU . 8.4 p -111.95 162.77 14.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.297 -171.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -48.84 -39.28 24.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.993 176.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 46.6 t80 -58.18 -55.95 28.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.231 176.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 33.8 p -66.23 -54.16 28.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.481 -174.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3636 ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.8 mm-40 -61.32 -35.15 76.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.795 -171.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 45.8 m -71.87 -46.0 59.38 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.058 0.456 . . . . 0.0 110.554 -178.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -63.32 -35.67 81.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.148 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.46 -32.9 74.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.031 176.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3640 ' ' SER . . . . . 1.053 ' HA ' HD21 ' A' 3647 ' ' LEU . 17.5 t -65.32 -35.76 81.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 0.0 110.08 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.97 -54.71 5.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.012 177.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.598 HD12 HD21 ' A' 3575 ' ' LEU . 28.2 mt -67.23 -39.62 86.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.463 -0.789 . . . . 0.0 112.821 -171.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.408 ' CB ' HG11 ' A' 3527 ' ' VAL . . . -147.61 75.24 11.24 Favored Pre-proline 0 C--N 1.327 -0.385 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3644 ' ' PRO . . . . . 0.436 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 48.9 Cg_endo -69.52 -19.9 36.65 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.412 2.075 . . . . 0.0 111.752 178.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3645 ' ' ASP . . . . . 0.487 ' OD2' ' HG3' ' A' 3504 ' ' LYS . 43.6 m-20 -70.68 -51.66 26.22 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.026 -177.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.599 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -79.52 -28.01 41.35 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 1.053 HD21 ' HA ' ' A' 3640 ' ' SER . 25.4 tp -52.06 -48.47 64.61 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.618 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.88 -20.33 63.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.492 -176.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 8.3 t -89.58 -33.56 16.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.175 178.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.513 HG12 ' HA ' ' A' 3647 ' ' LEU . 6.3 pt -80.81 -16.78 12.44 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.849 179.152 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 6.1 t -59.88 -21.14 60.62 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.41 0.624 . . . . 0.0 109.685 174.191 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -88.14 -39.21 14.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.353 174.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.505 HD12 ' HG2' ' A' 3655 ' ' PRO . 8.3 tp -105.22 43.15 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 122.461 1.124 . . . . 0.0 109.439 -179.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.474 ' N ' ' HD2' ' A' 3655 ' ' PRO . 20.3 m -37.19 -42.97 1.06 Allowed Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 113.98 -1.464 . . . . 0.0 113.524 172.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.505 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.8 Cg_endo -60.22 82.43 0.07 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.432 1.421 . . . . 0.0 111.661 168.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3656 ' ' HIS . . . . . 0.416 ' O ' ' HD3' ' A' 3631 ' ' PRO . 25.7 p80 -148.18 174.64 11.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.145 -177.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.578 HD12 HD12 ' A' 3595 ' ' LEU . 39.1 mt -120.96 150.34 41.26 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.446 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 59.2 ttp -111.82 109.65 19.59 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 173.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.585 HG12 HG12 ' A' 3628 ' ' ILE . 83.5 mt -101.31 114.76 41.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 121.248 0.547 . . . . 0.0 111.19 -173.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.676 HG12 ' HD2' ' A' 3573 ' ' TYR . 72.4 t -101.1 114.54 40.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.799 -177.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.644 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.0 mt -90.51 112.09 24.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -117.12 129.21 55.82 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 120.882 0.372 . . . . 0.0 111.621 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 27.9 m -103.02 108.45 19.63 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 169.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.328 179.36 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.565 ' CD1' ' HB2' ' A' 3553 ' ' MET . 31.0 m-85 . . . . . 0 N--CA 1.482 1.134 0 CA-C-O 119.745 -0.169 . . . . 0.0 111.408 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.519 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.5 OUTLIER 53.49 -155.54 0.21 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.761 0.791 . . . . 0.0 111.419 179.143 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 98.5 m -153.14 123.22 6.98 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.577 -1.192 . . . . 0.0 107.996 167.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.607 HD13 ' H ' ' B' 2522 ' ' SEP . 0.2 OUTLIER -78.52 -134.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -177.999 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.947 ' HA ' ' HB3' ' B' 2525 ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B 2523 ' ' ASP . . . . . 0.624 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 11.1 p-10 -72.19 -36.78 69.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.366 173.354 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B 2525 ' ' GLU . . . . . 0.947 ' HB3' ' HA ' ' B' 2522 ' ' SEP . 10.1 tp10 . . . . . 0 C--O 1.247 0.957 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.761 -177.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.637 HG12 ' HB3' ' A' 3648 ' ' ALA . 12.3 t . . . . . 0 N--CA 1.479 1.007 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3497 ' ' ASP . . . . . 0.469 ' OD1' HG23 ' A' 3499 ' ' VAL . 13.3 t70 -105.41 154.54 20.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.03 -172.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3498 ' ' MET . . . . . 0.486 ' HA ' ' CD2' ' A' 3501 ' ' LEU . 72.7 mtm -67.77 -19.61 65.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.865 -176.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.469 HG23 ' OD1' ' A' 3497 ' ' ASP . 98.2 t -62.61 -23.13 31.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 121.253 0.549 . . . . 0.0 111.054 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -81.63 -57.51 3.42 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 121.926 -0.484 . . . . 0.0 110.796 175.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.557 HD11 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp -58.32 -38.14 76.5 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -175.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.677 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -69.82 -15.81 63.17 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.557 0.617 . . . . 0.0 110.243 -172.363 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.594 ' N ' HD12 ' A' 3502 ' ' LEU . 28.2 mtpp -68.21 -24.73 64.97 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.2 175.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3504 ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 28.4 mmtp -101.59 -42.56 6.18 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.232 176.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.737 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -144.3 99.35 4.96 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-O 121.503 0.668 . . . . 0.0 110.533 179.414 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 3506 ' ' PRO . . . . . 0.677 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 92.6 Cg_endo -83.52 173.04 9.88 Favored 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 124.128 3.219 . . . . 0.0 113.958 -174.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.494 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 82.0 mt -73.64 138.6 20.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.394 -177.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 23.1 m -108.58 -31.42 2.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.217 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.795 ' CD1' HD11 ' A' 3524 ' ' LEU . 2.2 t-105 -138.75 148.84 44.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.391 -177.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -146.59 119.2 8.53 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 170.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3511 ' ' GLY . . . . . 0.452 ' O ' ' HA ' ' A' 3521 ' ' ALA . . . 177.97 -129.81 1.49 Allowed Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -175.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.579 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 4.9 mp -139.76 153.6 47.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.504 0.652 . . . . 0.0 111.931 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' 3519 ' ' THR . 69.1 mt -106.15 154.12 21.13 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 167.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.664 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -142.83 121.86 12.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 117.97 0.35 . . . . 0.0 111.829 -177.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.64 HD13 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.34 147.09 41.08 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 172.797 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.64 ' HD3' HD13 ' A' 3515 ' ' LEU . 0.8 OUTLIER 63.57 -99.25 0.07 Allowed 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -170.11 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -139.39 5.79 2.28 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.694 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 1.6 t0 -103.23 139.05 39.2 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.815 -172.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.515 HG22 ' HB2' ' A' 3514 ' ' ALA . 14.7 p -122.65 127.94 49.98 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.896 -177.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -115.74 115.51 26.46 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.602 177.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.579 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.01 112.67 6.57 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 121.299 0.571 . . . . 0.0 109.634 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.419 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 30.9 m -127.36 147.64 32.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.678 -176.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3523 ' ' GLN . . . . . 0.428 ' HG3' ' CE1' ' A' 3525 ' ' HIS . 20.2 pt20 -107.48 124.3 49.68 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.018 173.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.795 HD11 ' CD1' ' A' 3509 ' ' TRP . 4.8 mt -94.52 113.14 24.94 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.626 -176.368 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.494 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 56.5 m80 -91.03 142.6 27.6 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.688 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.737 ' O ' ' HB2' ' A' 3505 ' ' TYR . 60.0 t80 -70.02 137.31 51.24 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 172.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.617 ' CG1' HD22 ' A' 3575 ' ' LEU . 22.1 t -115.31 -55.8 4.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-O 121.383 0.611 . . . . 0.0 110.86 176.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.488 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 69.7 m -161.41 172.43 16.52 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.138 -171.253 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 84.51 -153.13 28.46 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.512 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.541 ' HB2' ' HA ' ' A' 3571 ' ' THR . 31.1 t30 -99.46 111.23 23.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.579 0.228 . . . . 0.0 111.102 -177.093 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -61.83 -29.02 69.89 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.313 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 98.7 t -58.79 -34.23 51.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.545 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.526 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 57.1 mt -59.3 -42.4 91.23 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.111 178.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.52 89.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.916 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -59.1 -38.72 80.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.166 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 9.0 ptm85 -88.5 -18.61 27.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -176.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.497 ' HB2' HD13 ' A' 3626 ' ' LEU . 43.9 p -92.27 -40.24 11.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.911 0.386 . . . . 0.0 111.193 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.553 HD12 ' HB2' ' A' 3509 ' ' TRP . 34.3 mt -79.39 120.98 82.29 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-O 121.108 0.48 . . . . 0.0 110.024 -174.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.95 -155.49 0.05 OUTLIER 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.429 2.752 . . . . 0.0 112.503 -177.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.455 ' HG ' ' HA3' ' A' 3544 ' ' GLY . 0.2 OUTLIER -107.91 148.49 29.56 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.253 176.836 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.24 -54.68 3.83 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.637 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -86.84 110.14 19.76 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.277 0.56 . . . . 0.0 110.102 179.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 94.67 -5.63 69.97 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -174.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3544 ' ' GLY . . . . . 0.455 ' HA3' ' HG ' ' A' 3540 ' ' LEU . . . -123.8 172.68 16.45 Favored Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 111.566 -0.613 . . . . 0.0 111.566 -179.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -91.58 134.8 1.61 Allowed 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 122.924 2.416 . . . . 0.0 112.843 177.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo -58.54 157.47 27.05 Favored 'Trans proline' 0 C--O 1.233 0.272 0 C-N-CA 122.817 2.344 . . . . 0.0 111.276 173.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.539 ' HB3' HD12 ' A' 3612 ' ' ILE . 36.9 mt -68.24 108.49 3.2 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.664 ' HA ' ' O ' ' A' 3514 ' ' ALA . 19.3 ptt180 -97.41 138.48 34.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.056 0.455 . . . . 0.0 111.301 -175.711 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.446 HD12 HD23 ' A' 3515 ' ' LEU . 18.9 mt -91.15 106.68 17.82 Favored 'Isoleucine or valine' 0 C--O 1.247 0.938 0 CA-C-O 122.068 0.937 . . . . 0.0 111.105 -175.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.471 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.5 -1.45 14.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.81 -173.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.646 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 39.9 mt-30 -148.1 173.21 13.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.41 0.148 . . . . 0.0 110.863 177.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.606 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -150.91 140.91 22.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.004 0.431 . . . . 0.0 111.402 -179.686 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.529 ' O ' ' HA ' ' A' 3608 ' ' ALA . 21.7 ttt -109.53 124.93 51.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.089 178.257 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -64.58 110.04 2.19 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.55 ' O ' HD12 ' A' 3555 ' ' LEU . 3.6 pp -79.24 97.57 6.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 118.559 -1.256 . . . . 0.0 108.605 176.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.538 ' O ' ' HG ' ' A' 3560 ' ' LEU . 44.9 mt-10 -118.07 164.03 15.73 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.471 -1.24 . . . . 0.0 109.225 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.471 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -49.99 -53.69 24.95 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.394 0.434 . . . . 0.0 111.52 -178.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 23.5 p -64.51 -39.81 94.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.482 -178.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.549 ' O ' HG21 ' A' 3563 ' ' VAL . 15.0 mm100 -66.75 -40.19 88.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.973 -179.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' 3556 ' ' GLU . 92.1 mt -61.19 -34.54 75.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.816 179.386 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.543 ' O ' ' HD3' ' A' 3565 ' ' ARG . 7.9 mm-40 -60.19 -49.67 76.69 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 174.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.58 -41.42 99.57 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.702 178.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.549 HG21 ' O ' ' A' 3559 ' ' GLN . 57.7 t -60.43 -44.77 96.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.731 0.301 . . . . 0.0 110.28 177.37 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -57.2 -36.82 71.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.394 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.543 ' HD3' ' O ' ' A' 3561 ' ' GLU . 10.5 mpt_? -58.31 -45.15 88.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.735 -0.211 . . . . 0.0 111.506 179.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3566 ' ' ARG . . . . . 0.418 ' HG2' ' O ' ' A' 3563 ' ' VAL . 18.8 ptp180 -78.77 -16.34 57.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.861 0.362 . . . . 0.0 110.452 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.495 ' HE2' HD13 ' A' 3575 ' ' LEU . 80.8 mtp -85.45 -22.01 28.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.575 0.702 . . . . 0.0 109.92 176.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 1.4 m -74.82 -23.46 58.47 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.26 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 39.7 t -98.01 87.76 1.64 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.358 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -74.23 107.72 6.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.541 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.6 m 150.57 -44.76 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.436 1.494 . . . . 0.0 107.769 -172.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.61 -31.1 24.45 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.832 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.853 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -119.62 158.93 25.39 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.213 0.53 . . . . 0.0 109.777 177.395 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.56 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 42.2 t -122.4 136.87 54.98 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 170.596 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.617 HD22 ' CG1' ' A' 3527 ' ' VAL . 14.2 tp -104.81 125.69 51.12 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.526 ' HB3' HD21 ' A' 3524 ' ' LEU . 70.6 mt -126.35 154.7 43.16 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.546 -177.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.664 ' HG ' HD13 ' A' 3646 ' ' LEU . 0.4 OUTLIER -122.08 107.03 11.72 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.099 179.697 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.501 ' HB1' HD11 ' A' 3659 ' ' ILE . . . -94.14 120.25 34.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.489 0.662 . . . . 0.0 110.356 -178.403 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.543 ' HG ' HD13 ' A' 3577 ' ' LEU . 57.8 mt -122.18 146.34 46.49 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.791 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.23 116.9 3.56 Favored 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.145 1.897 . . . . 0.0 111.551 176.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 30.3 p -104.43 117.07 33.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.117 0.484 . . . . 0.0 109.97 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3582 ' ' GLY . . . . . 0.483 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.42 138.59 14.08 Favored Glycine 0 N--CA 1.437 -1.271 0 C-N-CA 120.262 -0.971 . . . . 0.0 111.82 178.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3583 ' ' ARG . . . . . 0.48 ' HG3' ' OD2' ' A' 3587 ' ' ASP . 33.0 mtt85 -70.24 -30.46 67.53 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.706 0.765 . . . . 0.0 109.093 177.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.487 ' O ' HG21 ' A' 3588 ' ' VAL . 3.9 p30 -140.04 174.57 10.39 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.956 178.192 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -60.47 -40.73 92.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.825 0.345 . . . . 0.0 111.115 -175.109 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3586 ' ' GLU . . . . . 0.402 ' HB3' ' OD1' ' A' 3584 ' ' ASP . 35.0 tt0 -67.19 -44.41 79.7 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.057 0.456 . . . . 0.0 109.922 178.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.48 ' OD2' ' HG3' ' A' 3583 ' ' ARG . 5.5 t70 -55.98 -45.68 78.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.58 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.487 HG21 ' O ' ' A' 3584 ' ' ASP . 74.1 t -55.26 -54.7 22.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.828 178.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 82.1 t -58.4 -46.75 89.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.353 -178.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 46.9 t -60.54 -49.8 76.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.198 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -67.36 -30.34 70.11 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -177.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 83.2 m -61.92 -48.21 81.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.998 0.428 . . . . 0.0 110.026 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.9 -46.31 71.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.25 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 19.3 m -55.45 -47.51 75.93 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.517 178.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.558 HD13 HD12 ' A' 3657 ' ' LEU . 65.3 tp -63.57 -41.91 98.35 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.01 0.433 . . . . 0.0 110.332 176.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.59 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 1.9 ttmt -61.18 -50.12 74.45 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.011 -179.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3597 ' ' ALA . . . . . 0.413 ' N ' ' HG2' ' A' 3596 ' ' LYS . . . -73.66 -35.78 65.27 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -179.266 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.524 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -90.49 -46.35 8.38 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -171.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.623 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 11.6 m-85 -99.58 -50.0 4.22 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.822 0.344 . . . . 0.0 111.387 -175.371 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.59 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 28.5 mm -62.12 -58.69 6.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.735 -176.307 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 59.2 m -57.75 -38.54 75.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.247 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.685 ' CE2' HD21 ' A' 3603 ' ' LEU . 0.0 OUTLIER -67.72 -53.13 29.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.749 0.309 . . . . 0.0 110.627 179.277 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.685 HD21 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -69.21 -34.53 75.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.148 -170.225 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -70.58 -36.82 73.78 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.45 -37.71 74.36 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.816 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3606 ' ' LYS . . . . . 0.565 ' HG2' ' O ' ' A' 3602 ' ' TYR . 72.4 mmtt -73.56 -19.51 60.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.703 178.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3607 ' ' GLN . . . . . 0.444 ' O ' ' HG ' ' A' 3555 ' ' LEU . 74.6 mt-30 48.95 50.68 17.39 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -169.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.529 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -132.92 170.67 15.0 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.245 -172.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.606 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -105.27 118.15 35.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.258 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.68 105.89 1.3 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.336 177.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.646 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 34.4 mm -90.02 122.1 41.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-O 121.22 0.533 . . . . 0.0 111.181 -174.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.539 HD12 ' HB3' ' A' 3547 ' ' LEU . 32.4 mt -120.84 117.08 51.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.702 175.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 14.9 m120 -95.42 126.01 40.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.356 -176.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 32.1 m -123.83 147.17 52.88 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.351 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.463 ' HA ' ' O ' ' A' 3621 ' ' GLN . 92.5 Cg_endo -92.12 142.05 2.48 Favored 'Trans proline' 0 N--CA 1.445 -1.344 0 C-N-CA 122.363 2.042 . . . . 0.0 112.395 173.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3616 ' ' ASN . . . . . . . . . . . . . 42.0 t30 -65.13 118.12 46.49 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.854 175.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.74 119.03 5.34 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 123.149 2.566 . . . . 0.0 112.563 -177.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 105.02 -43.16 1.72 Allowed Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.948 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 16.4 m -88.87 -26.03 21.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.678 0.275 . . . . 0.0 110.581 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 6.0 t30 63.0 39.19 10.42 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.815 0.817 . . . . 0.0 109.378 -177.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.463 ' O ' ' HA ' ' A' 3615 ' ' PRO . 8.8 tp-100 -102.0 107.56 52.97 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.246 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.408 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 85.2 Cg_endo -78.39 24.33 0.56 Allowed 'Trans proline' 0 CA--C 1.528 0.209 0 C-N-CA 123.239 2.626 . . . . 0.0 112.779 -178.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -79.77 37.46 0.36 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.494 -177.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3624 ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -128.72 132.12 47.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.136 0.493 . . . . 0.0 110.131 176.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.493 HG13 ' HG3' ' A' 3627 ' ' GLN . 2.8 t -124.23 118.01 52.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.059 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.623 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -96.28 111.3 23.41 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 171.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.512 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 76.2 mt-30 -94.18 110.94 22.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.953 -178.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.577 HG12 HG12 ' A' 3659 ' ' ILE . 26.3 mt -92.94 99.46 9.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.356 -179.409 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -89.01 138.08 29.34 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.001 178.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.608 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 45.0 Cg_endo -68.05 168.83 17.91 Favored 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.639 2.226 . . . . 0.0 111.186 176.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -65.36 81.43 0.22 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.469 2.113 . . . . 0.0 111.673 177.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.537 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.9 p -113.24 162.6 15.82 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.523 -176.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -54.89 -35.81 64.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.832 0.349 . . . . 0.0 110.323 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 40.0 t80 -53.96 -53.59 50.77 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.114 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3635 ' ' SER . . . . . 0.41 ' O ' ' HG ' ' A' 3639 ' ' LEU . 49.9 p -69.92 -53.65 16.95 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.873 -177.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3636 ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' 3632 ' ' CYS . 20.6 mm-40 -61.12 -43.86 98.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.857 -172.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 41.6 t -66.56 -43.49 84.88 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.118 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 12.6 m80 -64.0 -36.22 83.27 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.544 176.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3639 ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' 3635 ' ' SER . 79.0 mt -64.93 -42.37 94.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.959 177.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.769 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 36.6 t -58.41 -35.13 71.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.267 0.556 . . . . 0.0 110.448 178.042 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -79.83 -50.24 10.8 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.823 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.567 HD13 HD21 ' A' 3575 ' ' LEU . 19.7 mt -75.31 -38.3 60.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.46 -171.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.516 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -146.54 87.56 6.4 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.806 0.336 . . . . 0.0 111.332 -179.429 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.66 -24.98 21.19 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.587 2.191 . . . . 0.0 113.712 -174.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 4.1 t70 -80.31 -40.28 27.1 Favored 'General case' 0 CA--C 1.513 -0.444 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.534 -171.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.664 HD13 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.82 -29.4 44.75 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 176.559 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.769 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.26 -44.64 71.99 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.046 176.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3648 ' ' ALA . . . . . 0.637 ' HB3' HG12 ' A' 3496 ' ' VAL . . . -59.37 -34.58 72.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.903 0.382 . . . . 0.0 111.067 -179.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 18.9 m -71.15 -41.8 69.96 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.916 0.389 . . . . 0.0 110.684 177.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.544 ' HA ' ' CG2' ' A' 3653 ' ' ILE . 5.2 pt -79.59 -17.58 12.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.514 -173.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 48.8 m -57.74 -26.14 61.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.148 0.499 . . . . 0.0 110.441 174.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -87.4 -37.39 17.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.141 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.544 ' CG2' ' HA ' ' A' 3650 ' ' ILE . 8.2 tp -104.91 43.64 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 122.406 1.098 . . . . 0.0 109.198 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.48 ' N ' ' HD2' ' A' 3655 ' ' PRO . 7.7 t -37.63 -43.46 1.41 Allowed Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 114.003 -1.453 . . . . 0.0 113.22 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.489 ' HG2' HD11 ' A' 3653 ' ' ILE . 15.3 Cg_endo -59.16 87.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 121.437 1.425 . . . . 0.0 111.601 169.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -154.83 177.95 10.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.399 -177.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.558 HD12 HD13 ' A' 3595 ' ' LEU . 43.5 mt -126.78 133.47 50.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.658 -179.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.7 tmm? -99.69 112.56 24.79 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.59 HD11 HD23 ' A' 3524 ' ' LEU . 75.8 mt -108.93 120.86 61.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 121.331 0.586 . . . . 0.0 111.838 -170.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.853 HG13 ' HD2' ' A' 3573 ' ' TYR . 63.7 t -103.65 116.64 47.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.779 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.623 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.8 mt -90.69 111.78 24.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 176.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.51 128.68 56.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.781 0.324 . . . . 0.0 111.404 -176.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 14.8 m -77.66 119.82 21.74 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.885 173.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 52.6 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.677 -0.677 . . . . 0.0 109.713 177.72 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.471 ' CD2' ' HB2' ' A' 3553 ' ' MET . 42.4 m-85 . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 111.347 0.129 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.994 ' HG3' ' H ' ' B' 2520 ' ' THR . 6.7 tp10 58.0 -150.79 0.43 Allowed 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 177.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 2520 ' ' THR . . . . . 0.994 ' H ' ' HG3' ' B' 2519 ' ' GLU . 33.7 m -154.98 126.59 7.44 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 174.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.615 ' HG ' ' N ' ' B' 2522 ' ' SEP . 36.2 tp -87.75 -128.65 0.06 Allowed 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.709 176.764 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.615 ' N ' ' HG ' ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B 2523 ' ' ASP . . . . . 0.593 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 1.0 OUTLIER -158.61 -60.84 0.08 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.748 -176.756 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 . . . . . 0 C--O 1.244 0.769 0 CA-C-O 118.638 -0.696 . . . . 0.0 110.151 176.246 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.871 HG13 ' HB3' ' A' 3649 ' ' SER . 58.5 t . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -106.22 111.81 24.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.855 0.36 . . . . 0.0 111.265 -178.433 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 84.7 mtp -79.53 -33.95 41.53 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.879 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 41.4 t -62.9 -23.35 32.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.293 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -81.76 -58.9 2.79 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 122.055 -0.403 . . . . 0.0 111.005 176.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.565 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp -64.5 -33.98 77.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -173.228 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.621 HD11 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.38 -15.61 63.78 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.682 -173.929 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.621 ' N ' HD11 ' A' 3502 ' ' LEU . 23.3 ttmm -61.46 -38.42 87.17 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.063 0.459 . . . . 0.0 110.14 176.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3504 ' ' LYS . . . . . 0.545 ' HD2' ' CD2' ' A' 3505 ' ' TYR . 7.5 tmtt? -94.66 -41.96 9.02 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.735 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -144.4 100.89 4.77 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.375 -177.111 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 3506 ' ' PRO . . . . . 0.429 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 77.8 Cg_endo -87.61 173.43 5.33 Favored 'Trans proline' 0 CA--C 1.531 0.356 0 C-N-CA 124.257 3.304 . . . . 0.0 113.364 -179.274 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.5 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 85.9 mt -71.6 128.96 35.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.719 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3508 ' ' VAL . . . . . 0.438 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.0 m -98.48 -29.69 3.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.36 -178.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.563 ' CB ' HD13 ' A' 3538 ' ' LEU . 6.4 t-105 -153.57 158.16 40.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.21 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 25.1 tt0 -150.45 119.76 6.84 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 177.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.16 -132.56 1.41 Allowed Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.758 -0.734 . . . . 0.0 111.276 -176.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.608 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -139.85 153.21 46.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.056 0.455 . . . . 0.0 111.063 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.453 HD23 ' HB2' ' A' 3547 ' ' LEU . 73.7 mt -110.58 150.53 28.81 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 171.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.667 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.3 125.42 15.4 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -177.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.589 HD11 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.67 143.98 39.42 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 171.89 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.589 ' HD3' HD11 ' A' 3515 ' ' LEU . 0.2 OUTLIER 62.29 -94.94 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 -168.784 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 13.4 m120 -142.66 5.74 1.6 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.727 174.187 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.403 ' O ' ' HA ' ' A' 3514 ' ' ALA . 26.4 m-20 -92.96 136.18 33.49 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.964 0.412 . . . . 0.0 110.727 -175.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.445 HG22 ' HB1' ' A' 3514 ' ' ALA . 13.4 p -123.98 140.69 52.73 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.219 -177.002 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.41 115.65 14.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.12 176.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.608 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -69.7 118.63 12.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.212 0.529 . . . . 0.0 109.857 175.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 27.3 m -131.07 147.55 33.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.82 -176.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -105.59 125.74 51.34 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.036 173.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.623 HD21 HD12 ' A' 3576 ' ' LEU . 0.9 OUTLIER -95.24 108.17 20.31 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.805 -175.797 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.5 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 71.4 m-70 -83.75 140.97 31.76 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.678 174.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.735 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.4 t80 -68.6 140.58 55.56 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 172.558 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.627 ' CG1' HD21 ' A' 3575 ' ' LEU . 23.5 t -116.15 -53.06 4.58 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.373 0.606 . . . . 0.0 110.903 175.591 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.418 ' OG ' HD23 ' A' 3642 ' ' LEU . 39.4 t -162.38 170.81 18.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.268 -171.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.54 -147.83 20.19 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.885 176.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.558 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.8 t-20 -107.99 114.66 28.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.853 0.358 . . . . 0.0 110.845 -177.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -62.17 -32.37 72.98 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.811 -177.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3532 ' ' VAL . . . . . 0.518 ' O ' ' HG2' ' A' 3536 ' ' ARG . 45.4 t -60.06 -35.6 62.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.148 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.47 HD22 ' HD3' ' A' 3536 ' ' ARG . 16.9 mt -55.6 -40.24 71.79 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.404 177.525 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.478 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.31 -44.57 83.08 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.452 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 5.2 t60 -63.82 -32.49 74.02 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.049 -178.496 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3536 ' ' ARG . . . . . 0.518 ' HG2' ' O ' ' A' 3532 ' ' VAL . 10.8 ptm180 -88.62 -11.69 44.73 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.196 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.492 ' HB2' HD12 ' A' 3626 ' ' LEU . 34.2 p -103.92 -40.37 6.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 111.396 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.563 HD13 ' CB ' ' A' 3509 ' ' TRP . 16.7 mt -80.2 114.42 46.76 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -176.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3539 ' ' PRO . . . . . 0.426 ' HB2' ' HG2' ' A' 3545 ' ' PRO . 30.3 Cg_endo -64.84 136.31 48.43 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.174 1.916 . . . . 0.0 111.871 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 3.2 pp -170.96 142.39 1.85 Allowed 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.599 -177.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 12.0 t -168.7 -38.04 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.092 -178.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -160.03 99.79 1.38 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.846 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 100.29 -88.48 0.77 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.855 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 155.68 101.14 0.18 Allowed Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.326 179.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3545 ' ' PRO . . . . . 0.46 ' HA ' ' HD3' ' A' 3546 ' ' PRO . 14.3 Cg_exo -69.36 136.2 33.42 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.956 2.437 . . . . 0.0 111.642 177.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.496 ' HA ' ' O ' ' A' 3512 ' ' LEU . 6.3 Cg_exo -76.59 124.78 7.83 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.445 2.097 . . . . 0.0 112.318 -179.16 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.538 ' HB3' HD13 ' A' 3612 ' ' ILE . 42.7 mt -69.32 110.93 4.9 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.015 176.399 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.667 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -96.97 138.37 34.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.116 0.484 . . . . 0.0 111.103 -177.541 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.484 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.3 mt -87.93 112.38 23.5 Favored 'Isoleucine or valine' 0 C--O 1.242 0.666 0 CA-C-O 121.872 0.844 . . . . 0.0 111.422 -173.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.539 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -121.47 4.9 10.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.786 -174.564 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.707 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 48.8 mt-30 -152.23 173.06 15.46 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.63 177.081 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.734 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.47 139.41 11.76 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.855 0.359 . . . . 0.0 111.654 -179.478 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.585 ' HB2' ' CD2' ' B' 2518 ' ' TYR . 13.7 tmm? -111.92 120.11 40.79 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.076 176.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -68.55 110.01 4.01 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.587 HD11 ' O ' ' A' 3555 ' ' LEU . 2.5 pp -69.77 98.38 1.2 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 122.241 1.02 . . . . 0.0 110.006 -175.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.603 ' O ' ' HG ' ' A' 3560 ' ' LEU . 38.1 mm-40 -116.83 159.16 22.78 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.535 179.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -50.19 -50.13 50.29 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.321 0.388 . . . . 0.0 111.392 -177.149 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 5.9 p -63.28 -43.91 96.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.646 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.465 ' O ' HG22 ' A' 3563 ' ' VAL . 16.9 mm-40 -66.28 -38.97 89.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.302 -178.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' 3556 ' ' GLU . 87.4 mt -61.95 -35.02 77.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.568 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' 3557 ' ' ALA . 76.1 mm-40 -60.91 -47.17 87.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.951 174.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -59.49 -35.74 86.61 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.637 176.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.518 ' O ' ' HG3' ' A' 3567 ' ' MET . 60.2 t -67.5 -53.66 30.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.828 0.347 . . . . 0.0 110.208 176.619 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3564 ' ' ALA . . . . . 0.475 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.1 -26.58 66.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.489 -178.461 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -58.33 -40.25 81.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3566 ' ' ARG . . . . . 0.43 ' HG2' ' O ' ' A' 3563 ' ' VAL . 12.0 ptp180 -88.38 -14.3 38.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.927 0.394 . . . . 0.0 110.791 177.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.518 ' HG3' ' O ' ' A' 3563 ' ' VAL . 88.1 mtp -79.03 -26.61 43.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.166 -178.886 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 8.5 t -74.99 -9.09 58.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.059 0.457 . . . . 0.0 110.644 -178.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 42.3 t -115.95 91.15 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.061 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -70.43 108.06 4.1 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 178.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.558 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.0 m 153.19 -46.22 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 O-C-N 125.046 1.466 . . . . 0.0 108.089 -173.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.31 -25.94 33.51 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.929 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.674 ' HD2' HG11 ' A' 3660 ' ' VAL . 0.1 OUTLIER -128.91 162.6 27.15 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.016 177.751 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.607 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 31.1 t -126.53 135.14 50.91 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.629 HD11 ' HE2' ' A' 3573 ' ' TYR . 13.3 tp -105.83 125.97 51.62 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.623 HD12 HD21 ' A' 3524 ' ' LEU . 67.7 mt -126.3 155.88 41.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.297 0.57 . . . . 0.0 111.035 -176.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.559 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -124.24 107.06 10.8 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.94 -179.689 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.437 ' HB2' HD11 ' A' 3659 ' ' ILE . . . -94.64 119.74 33.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.379 0.609 . . . . 0.0 110.346 -177.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.443 ' HG ' HD11 ' A' 3577 ' ' LEU . 74.5 mt -119.44 143.78 35.23 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.238 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.93 112.8 1.4 Allowed 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 122.429 2.086 . . . . 0.0 111.641 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 28.5 p -101.93 113.49 26.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.196 0.522 . . . . 0.0 110.517 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.85 145.43 16.12 Favored Glycine 0 N--CA 1.438 -1.175 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.967 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3583 ' ' ARG . . . . . 0.434 ' HE ' ' CG ' ' A' 3587 ' ' ASP . 45.6 mtm180 -71.69 -34.46 69.67 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.697 0.76 . . . . 0.0 109.962 178.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.527 ' O ' HG21 ' A' 3588 ' ' VAL . 14.5 t70 -133.35 165.97 23.61 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.192 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3585 ' ' GLN . . . . . 0.416 ' O ' HG21 ' A' 3589 ' ' VAL . 36.2 tt0 -53.82 -37.46 63.59 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.069 0.461 . . . . 0.0 110.299 176.603 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -65.99 -44.8 83.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.279 176.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.436 ' HB3' ' H ' ' A' 3584 ' ' ASP . 14.8 t70 -64.46 -41.02 96.76 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.633 -177.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.527 HG21 ' O ' ' A' 3584 ' ' ASP . 88.7 t -56.93 -48.0 82.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.321 178.183 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3589 ' ' VAL . . . . . 0.416 HG21 ' O ' ' A' 3585 ' ' GLN . 88.9 t -59.0 -47.34 90.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.391 178.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 22.4 t -62.53 -41.59 98.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.006 -179.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3591 ' ' GLN . . . . . 0.587 ' NE2' ' H ' ' A' 3521 ' ' ALA . 13.1 mm100 -67.95 -38.26 82.59 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 122.318 -0.239 . . . . 0.0 110.761 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3592 ' ' THR . . . . . 0.525 HG23 ' HE2' ' A' 3596 ' ' LYS . 44.9 m -62.6 -52.24 64.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.702 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3593 ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.6 pt-20 -62.71 -41.76 99.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.619 0.247 . . . . 0.0 111.146 -178.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.5 m -61.23 -46.64 89.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.852 0.358 . . . . 0.0 110.572 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.577 HD11 HD13 ' A' 3657 ' ' LEU . 50.3 tp -63.48 -42.55 98.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.762 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.552 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 57.7 mtmt -62.53 -45.53 92.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.506 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.03 -33.32 59.63 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.508 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -93.94 -46.65 7.07 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -172.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.707 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 21.4 m-85 -100.55 -50.93 3.74 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -176.214 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.552 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.0 mm -61.51 -60.9 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.276 -174.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 60.8 m -59.4 -40.59 87.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.3 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.707 ' HD2' ' HA ' ' A' 3599 ' ' PHE . 0.0 OUTLIER -65.04 -50.38 66.45 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.838 0.351 . . . . 0.0 110.835 -179.726 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.69 HD21 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -70.36 -36.05 73.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.911 -170.528 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -75.78 -29.17 58.68 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.942 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.31 -40.34 77.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.122 0.486 . . . . 0.0 110.175 176.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -73.46 -19.1 61.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.266 177.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3607 ' ' GLN . . . . . 0.442 ' O ' ' HG ' ' A' 3555 ' ' LEU . 46.4 mt-30 46.97 58.31 4.89 Favored 'General case' 0 C--O 1.232 0.161 0 O-C-N 123.815 0.697 . . . . 0.0 109.139 -168.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.422 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -140.88 174.59 10.37 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.38 0.61 . . . . 0.0 112.214 -172.194 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.734 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -108.28 117.54 34.43 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.453 174.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -65.34 103.73 0.85 Allowed Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 176.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.707 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 29.8 mm -89.32 123.37 41.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 121.374 0.607 . . . . 0.0 110.902 -174.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.538 HD13 ' HB3' ' A' 3547 ' ' LEU . 48.0 mt -120.82 111.92 33.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.179 174.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 6.6 m120 -88.84 136.18 33.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.872 -175.062 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.491 ' HB ' ' HB2' ' A' 3624 ' ' TYR . 46.1 t -116.55 122.97 31.08 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-O 120.766 0.317 . . . . 0.0 110.193 178.396 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.604 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 73.0 Cg_endo -100.25 141.19 0.29 Allowed 'Trans proline' 0 N--CA 1.444 -1.386 0 C-N-CA 123.333 2.689 . . . . 0.0 113.635 176.467 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.692 ' HB3' ' HB2' ' A' 3619 ' ' SER . 12.0 m120 -124.84 97.85 37.81 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 171.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -48.9 101.62 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 123.516 2.81 . . . . 0.0 113.026 -174.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 80.65 -26.83 3.04 Favored Glycine 0 CA--C 1.52 0.399 0 CA-C-N 115.969 -0.56 . . . . 0.0 113.039 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3619 ' ' SER . . . . . 0.692 ' HB2' ' HB3' ' A' 3616 ' ' ASN . 5.0 m -78.65 -34.91 46.02 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.741 -0.27 . . . . 0.0 111.587 -174.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3620 ' ' ASN . . . . . 0.409 ' O ' ' HB2' ' A' 3621 ' ' GLN . 5.5 t30 -160.92 -6.72 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.554 -178.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.838 ' HB3' ' HD2' ' A' 3622 ' ' PRO . 26.3 mp0 66.99 178.4 0.05 OUTLIER Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.412 -178.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.838 ' HD2' ' HB3' ' A' 3621 ' ' GLN . 48.5 Cg_endo -68.92 25.59 0.15 Allowed 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 123.091 2.528 . . . . 0.0 113.592 175.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3623 ' ' ALA . . . . . 0.456 ' H ' ' C ' ' A' 3621 ' ' GLN . . . -75.67 35.73 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -176.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.491 ' HB2' ' HB ' ' A' 3614 ' ' VAL . 64.6 m-85 -124.16 134.03 53.42 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 175.228 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.441 HG11 HD12 ' A' 3611 ' ' ILE . 2.9 t -130.68 116.65 35.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.79 175.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.581 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -100.84 113.79 27.04 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 170.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.508 ' O ' ' HA ' ' A' 3659 ' ' ILE . 78.5 mt-30 -94.41 111.09 22.83 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.715 -178.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.582 HG12 HG12 ' A' 3659 ' ' ILE . 44.9 mt -92.24 98.62 8.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-O 121.024 0.44 . . . . 0.0 110.181 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -89.42 141.21 28.71 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.973 178.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.472 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 39.8 Cg_endo -67.05 172.93 9.14 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.583 2.188 . . . . 0.0 111.077 176.047 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -68.95 41.85 0.28 Allowed 'Trans proline' 0 CA--C 1.535 0.57 0 C-N-CA 122.739 2.293 . . . . 0.0 112.724 175.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.486 ' O ' ' HG2' ' A' 3636 ' ' GLU . 27.0 p -77.4 162.1 27.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.726 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -54.9 -35.23 63.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.303 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 28.6 t80 -53.9 -52.33 60.87 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.004 0.43 . . . . 0.0 110.601 176.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3635 ' ' SER . . . . . 0.45 ' HA ' ' HE3' ' A' 3658 ' ' MET . 7.1 m -62.46 -56.64 16.25 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.654 -178.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3636 ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.5 mm-40 -58.3 -43.05 87.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.869 -172.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 35.6 p -62.8 -47.91 81.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.055 0.455 . . . . 0.0 110.754 -178.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 69.4 m80 -66.9 -34.76 78.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.436 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3639 ' ' LEU . . . . . 0.432 HD23 HG13 ' A' 3527 ' ' VAL . 82.1 mt -63.48 -32.85 74.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.841 175.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.669 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 19.3 m -69.44 -33.8 73.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.198 0.523 . . . . 0.0 110.399 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -84.13 -34.52 24.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.337 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.57 HD12 HD22 ' A' 3575 ' ' LEU . 19.3 mt -93.73 -24.56 17.78 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -172.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.447 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -154.54 75.0 5.83 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.628 0.251 . . . . 0.0 111.388 178.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.77 -24.9 61.24 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.599 2.199 . . . . 0.0 113.417 -175.155 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 10.0 t70 -75.78 -55.15 5.91 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.566 ' HB3' ' CE1' ' A' 3505 ' ' TYR . 0.1 OUTLIER -68.13 -30.57 69.75 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 179.858 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.669 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -53.96 -47.63 71.12 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.217 176.261 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -65.55 -19.07 65.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.874 0.368 . . . . 0.0 111.189 -178.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.871 ' HB3' HG13 ' A' 3496 ' ' VAL . 70.8 m -87.74 -35.35 17.96 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.872 176.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.518 ' HA ' ' CG2' ' A' 3653 ' ' ILE . 4.1 pt -79.94 -15.21 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.063 -178.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 49.0 m -61.92 -20.36 63.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.085 0.469 . . . . 0.0 110.181 175.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -88.31 -38.12 15.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.27 173.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.518 ' CG2' ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -104.42 44.07 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 122.508 1.147 . . . . 0.0 108.853 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.468 ' N ' ' HD2' ' A' 3655 ' ' PRO . 16.1 m -32.62 -47.69 0.51 Allowed Pre-proline 0 N--CA 1.468 0.435 0 CA-C-N 113.624 -1.625 . . . . 0.0 113.174 171.122 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.486 ' HG2' HD13 ' A' 3653 ' ' ILE . 14.7 Cg_endo -59.08 88.71 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.605 1.537 . . . . 0.0 111.9 170.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -154.66 169.64 23.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.369 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.577 HD13 HD11 ' A' 3595 ' ' LEU . 56.9 mt -121.88 133.71 54.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.371 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3658 ' ' MET . . . . . 0.45 ' HE3' ' HA ' ' A' 3635 ' ' SER . 15.7 tmm? -100.38 111.65 23.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.582 HG12 HG12 ' A' 3628 ' ' ILE . 75.9 mt -106.36 120.27 57.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.59 -170.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.674 HG11 ' HD2' ' A' 3573 ' ' TYR . 87.9 t -103.76 114.83 44.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.884 -178.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.607 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 69.7 mt -91.15 120.17 39.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.059 177.659 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -116.62 126.27 53.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.658 0.266 . . . . 0.0 110.763 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 23.4 p -96.91 122.85 40.34 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.282 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 33.8 t . . . . . 0 C--O 1.251 1.181 0 O-C-N 123.561 0.538 . . . . 0.0 110.983 178.531 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.585 ' CD2' ' HB2' ' A' 3553 ' ' MET . 7.2 m-85 . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 111.454 0.168 . . . . 0.0 111.454 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.844 ' HG2' ' H ' ' B' 2520 ' ' THR . 54.6 tt0 56.97 -150.11 0.45 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 2520 ' ' THR . . . . . 0.844 ' H ' ' HG2' ' B' 2519 ' ' GLU . 5.9 t -167.32 132.34 1.99 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 175.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.731 HD11 HH11 ' A' 3552 ' ' ARG . 1.4 tp -87.16 -118.53 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 120.415 -0.514 . . . . 0.0 110.019 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B 2522 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 25.8 t70 -149.51 -65.6 0.22 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.963 172.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 3.4 mp0 . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.46 -0.781 . . . . 0.0 109.789 179.147 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.633 HG11 ' HB3' ' A' 3649 ' ' SER . 48.8 t . . . . . 0 N--CA 1.477 0.902 0 CA-C-O 121.02 0.438 . . . . 0.0 110.414 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 13.7 t70 -99.98 110.68 22.99 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 176.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 72.6 mtm -82.9 -9.98 59.04 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.148 0.499 . . . . 0.0 111.285 -177.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 15.0 t -72.53 -21.13 19.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.094 -176.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -83.18 -59.07 2.59 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.879 -0.513 . . . . 0.0 111.515 176.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.533 HD12 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp -55.29 -36.56 66.29 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.33 0.863 . . . . 0.0 113.33 -176.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.753 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -69.22 -15.31 63.35 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.501 -173.798 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.597 ' N ' HD11 ' A' 3502 ' ' LEU . 52.2 tptt -68.71 -24.0 64.43 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.541 176.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -100.32 -43.03 6.4 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.037 174.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.696 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -149.16 104.07 3.34 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.637 -179.104 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3506 ' ' PRO . . . . . 0.753 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 84.5 Cg_endo -84.51 173.97 8.16 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 123.988 3.125 . . . . 0.0 113.938 -174.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3507 ' ' ILE . . . . . . . . . . . . . 86.4 mt -71.83 133.42 31.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.915 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 26.9 m -100.94 -30.59 3.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.51 -178.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.595 ' CB ' HD12 ' A' 3538 ' ' LEU . 34.1 t-105 -150.23 149.72 30.57 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -143.77 119.35 10.4 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -174.48 -127.46 1.01 Allowed Glycine 0 N--CA 1.443 -0.853 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 -177.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.591 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -138.96 158.5 44.09 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.176 0.512 . . . . 0.0 111.124 177.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.466 HD22 ' HB2' ' A' 3547 ' ' LEU . 89.7 mt -108.93 148.88 30.01 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 168.754 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.703 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -142.85 129.33 20.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.848 0.356 . . . . 0.0 111.182 -179.076 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.753 HD11 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.32 138.15 39.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 171.655 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.753 ' CD ' HD11 ' A' 3515 ' ' LEU . 0.1 OUTLIER 63.94 -93.96 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -168.693 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 6.0 m120 -144.28 10.25 1.47 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.353 173.28 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.463 ' O ' ' HA ' ' A' 3514 ' ' ALA . 8.8 m-20 -86.72 132.98 33.71 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.218 -177.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 24.7 p -122.5 129.86 52.43 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.324 0.583 . . . . 0.0 111.945 -175.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -130.71 115.03 16.12 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.075 173.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.591 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.74 125.11 25.93 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.462 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 35.0 m -130.91 149.53 33.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.585 0.707 . . . . 0.0 111.972 -174.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -113.0 124.09 51.84 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.304 170.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.663 HD23 HD13 ' A' 3576 ' ' LEU . 0.8 OUTLIER -94.01 111.21 22.9 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.636 -174.319 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.412 ' CE1' HD11 ' A' 3579 ' ' LEU . 74.4 m80 -88.72 136.34 33.05 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.981 -1.008 . . . . 0.0 108.928 177.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.696 ' O ' ' HB2' ' A' 3505 ' ' TYR . 61.0 t80 -67.6 138.31 56.33 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.616 ' CG1' HD22 ' A' 3575 ' ' LEU . 21.9 t -114.59 -56.67 4.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.243 0.544 . . . . 0.0 110.812 176.111 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.443 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 61.4 m -160.52 171.4 19.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.91 -171.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.19 -152.77 23.01 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.8 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.558 ' HB2' ' HA ' ' A' 3571 ' ' THR . 48.1 t-20 -91.97 111.3 22.78 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -177.668 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -64.26 -33.21 75.3 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.929 0.395 . . . . 0.0 110.788 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 60.6 t -62.52 -30.34 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.294 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.506 HD22 ' HD3' ' A' 3536 ' ' ARG . 15.8 mt -59.47 -41.42 89.72 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.354 178.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -68.96 -41.35 78.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.986 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 80.7 t60 -63.69 -33.64 76.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.111 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3536 ' ' ARG . . . . . 0.506 ' HD3' HD22 ' A' 3533 ' ' LEU . 14.4 ptm180 -89.92 -11.73 40.94 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.225 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.469 ' O ' HG13 ' A' 3614 ' ' VAL . 47.5 p -103.7 -38.28 7.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.728 0.299 . . . . 0.0 111.522 -179.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.595 HD12 ' CB ' ' A' 3509 ' ' TRP . 20.3 mt -81.42 110.11 17.34 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.955 0.407 . . . . 0.0 110.005 -176.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3539 ' ' PRO . . . . . 0.79 ' HB2' ' HA3' ' A' 3543 ' ' GLY . 58.6 Cg_endo -76.54 156.2 36.14 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.936 2.424 . . . . 0.0 113.03 -175.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.489 ' HB3' ' CZ3' ' A' 3509 ' ' TRP . 0.8 OUTLIER -162.42 146.28 11.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.606 -179.173 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 50.6 m 70.79 -40.72 0.48 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.824 0.85 . . . . 0.0 111.233 -177.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3542 ' ' GLU . . . . . 0.447 ' H ' ' C ' ' A' 3540 ' ' LEU . 0.4 OUTLIER -109.42 -14.93 14.34 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.647 0.737 . . . . 0.0 110.255 175.557 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3543 ' ' GLY . . . . . 0.79 ' HA3' ' HB2' ' A' 3539 ' ' PRO . . . -136.17 40.45 1.53 Allowed Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.069 178.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3544 ' ' GLY . . . . . 0.661 ' N ' ' HD2' ' A' 3545 ' ' PRO . . . -62.33 -41.01 99.76 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-O 118.901 -0.944 . . . . 0.0 113.881 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3545 ' ' PRO . . . . . 0.661 ' HD2' ' N ' ' A' 3544 ' ' GLY . 2.3 Cg_endo -41.36 146.4 0.44 Allowed 'Trans proline' 0 C--N 1.362 1.252 0 C-N-CA 123.295 2.664 . . . . 0.0 112.692 174.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 32.0 Cg_exo -55.78 150.0 47.48 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.754 2.303 . . . . 0.0 112.68 -175.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.608 ' HB3' HD12 ' A' 3612 ' ' ILE . 22.5 mt -67.7 113.91 5.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.63 179.12 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.703 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -96.62 138.16 34.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.133 0.492 . . . . 0.0 112.028 -172.061 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3549 ' ' ILE . . . . . . . . . . . . . 19.4 mt -95.98 107.57 19.89 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-O 122.236 1.017 . . . . 0.0 111.694 -172.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -113.93 -2.61 13.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.054 -173.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.655 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 69.4 mt-30 -146.81 176.72 9.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.359 0.123 . . . . 0.0 110.872 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.792 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.45 140.58 12.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.952 0.406 . . . . 0.0 111.604 179.285 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.577 ' HB2' ' CD2' ' B' 2518 ' ' TYR . 14.8 tmm? -109.71 122.8 48.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.174 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 8.5 mmm180 -69.88 110.07 4.8 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 -177.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.508 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -73.52 98.3 2.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.281 1.039 . . . . 0.0 109.524 -177.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' 3560 ' ' LEU . 34.2 mt-10 -111.49 171.67 7.34 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.67 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.4 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -57.54 -51.34 69.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.843 0.354 . . . . 0.0 111.041 -179.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 36.1 p -65.91 -32.81 74.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.387 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.573 ' O ' HG22 ' A' 3563 ' ' VAL . 18.9 mm-40 -71.53 -40.54 70.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.093 179.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.606 ' HG ' ' O ' ' A' 3556 ' ' GLU . 84.8 mt -60.06 -34.27 73.2 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.019 0.437 . . . . 0.0 110.109 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' 3557 ' ' ALA . 17.5 mm-40 -60.9 -49.74 76.24 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.119 173.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -65.02 -30.2 77.37 Favored Glycine 0 CA--C 1.52 0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.771 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.597 ' O ' ' HG3' ' A' 3567 ' ' MET . 59.8 t -66.71 -53.87 30.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 174.917 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.22 -31.06 68.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.594 178.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -53.08 -51.82 60.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.691 176.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3566 ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' 3566 ' ' ARG . 14.0 ptt-85 -83.04 -9.28 59.33 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.093 0.473 . . . . 0.0 111.046 -178.266 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.597 ' HG3' ' O ' ' A' 3563 ' ' VAL . 81.2 mtp -84.5 -22.72 30.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.812 178.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 43.5 p -77.42 -5.73 50.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.035 0.445 . . . . 0.0 110.988 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 20.5 t -119.34 78.7 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.798 175.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.0 108.85 1.93 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.66 176.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.558 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 1.8 m 153.05 -41.73 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 O-C-N 124.921 1.388 . . . . 0.0 108.346 -176.117 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -84.96 -26.23 27.3 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.641 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.674 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -124.93 164.81 19.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.757 177.834 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.627 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 33.7 t -127.49 136.61 52.0 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 172.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.616 HD22 ' CG1' ' A' 3527 ' ' VAL . 13.0 tp -105.73 125.12 50.61 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.663 HD13 HD23 ' A' 3524 ' ' LEU . 67.7 mt -126.85 155.24 43.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.115 0.483 . . . . 0.0 111.035 -177.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.692 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.3 OUTLIER -123.79 107.19 11.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.203 179.257 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.456 ' HB2' HD11 ' A' 3659 ' ' ILE . . . -94.35 122.61 37.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.527 0.679 . . . . 0.0 110.488 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.459 HD23 HG22 ' A' 3650 ' ' ILE . 68.8 mt -122.88 147.58 51.53 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.658 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3580 ' ' PRO . . . . . 0.425 ' HA ' ' O ' ' A' 3521 ' ' ALA . 13.8 Cg_endo -57.42 125.47 18.93 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 122.096 1.864 . . . . 0.0 111.829 176.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 29.8 p -107.61 119.19 38.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.308 0.575 . . . . 0.0 110.164 178.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.49 146.08 16.13 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.769 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3583 ' ' ARG . . . . . 0.424 ' HG3' ' OD2' ' A' 3587 ' ' ASP . 35.6 mtp180 -69.97 -20.53 63.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.7 0.762 . . . . 0.0 108.946 173.92 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.589 ' O ' HG23 ' A' 3588 ' ' VAL . 9.7 t70 -154.26 169.55 23.39 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.553 -1.203 . . . . 0.0 107.876 -178.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -56.69 -44.69 81.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 118.165 0.439 . . . . 0.0 110.905 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.72 -35.51 80.8 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.484 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.424 ' OD2' ' HG3' ' A' 3583 ' ' ARG . 20.3 t70 -68.02 -40.72 82.9 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.194 -178.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' 3584 ' ' ASP . 73.9 t -56.12 -45.15 80.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.511 177.023 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 85.6 t -55.78 -46.96 80.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.786 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 28.7 t -65.28 -43.79 90.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.026 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -64.24 -37.28 86.91 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.49 179.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 90.1 m -60.95 -54.96 38.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.612 177.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -65.54 -36.0 82.52 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.276 -177.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 20.9 t -65.32 -44.42 87.86 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.575 HD13 HD11 ' A' 3657 ' ' LEU . 58.7 tp -64.66 -45.96 84.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.119 -178.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.789 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.62 -29.3 69.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.324 -176.42 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -85.6 -41.05 15.59 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.245 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -86.87 -46.36 9.99 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -171.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.478 ' HB2' HD12 ' A' 3595 ' ' LEU . 11.2 m-85 -98.91 -50.74 4.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.806 0.336 . . . . 0.0 111.212 -175.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.789 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 24.8 mm -59.8 -54.55 33.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.978 -176.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3601 ' ' THR . . . . . 0.455 ' O ' ' HG3' ' A' 3604 ' ' GLN . 59.2 m -62.42 -38.4 89.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.431 -178.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 43.0 t80 -72.05 -54.32 10.2 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.116 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.48 HD11 ' O ' ' A' 3608 ' ' ALA . 0.4 OUTLIER -57.01 -38.78 73.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.794 179.85 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3604 ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' 3601 ' ' THR . 0.0 OUTLIER -72.29 -34.64 68.32 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.149 -179.819 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -64.86 -36.98 86.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.874 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -84.1 -18.14 37.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.119 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 51.21 55.38 9.58 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -169.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.5 ' HB1' ' HB2' ' A' 3552 ' ' ARG . . . -135.21 -177.63 4.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.256 0.551 . . . . 0.0 112.113 -173.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.792 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.65 117.46 28.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.672 175.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -62.81 104.48 0.8 Allowed Glycine 0 C--O 1.224 -0.517 0 C-N-CA 120.751 -0.738 . . . . 0.0 111.365 178.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.655 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.5 mm -89.86 124.01 42.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.322 0.582 . . . . 0.0 110.884 -174.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.608 HD12 ' HB3' ' A' 3547 ' ' LEU . 45.7 mt -119.78 108.66 24.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.607 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.401 ' HA ' ' O ' ' A' 3624 ' ' TYR . 87.2 m-20 -85.22 121.17 27.58 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.67 -176.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.469 HG13 ' O ' ' A' 3537 ' ' SER . 48.4 t -105.88 124.96 34.4 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.983 -178.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.587 ' HA ' ' O ' ' A' 3621 ' ' GLN . 93.9 Cg_endo -90.99 138.22 2.34 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.687 2.258 . . . . 0.0 112.053 171.565 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.541 HD22 ' HE2' ' A' 3624 ' ' TYR . 20.7 m120 -67.73 127.49 93.38 Favored Pre-proline 0 C--N 1.322 -0.623 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.035 178.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -52.05 114.9 1.83 Allowed 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 123.107 2.538 . . . . 0.0 112.432 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 96.63 -40.8 2.49 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.165 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3619 ' ' SER . . . . . 0.515 ' HB2' ' HB2' ' A' 3616 ' ' ASN . 44.3 m -81.55 -29.42 33.49 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.67 0.271 . . . . 0.0 110.935 -179.584 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3620 ' ' ASN . . . . . 0.453 ' O ' ' HD3' ' A' 3622 ' ' PRO . 3.9 m-20 61.72 28.19 17.35 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.673 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.587 ' O ' ' HA ' ' A' 3615 ' ' PRO . 25.9 tp60 -89.46 106.81 15.01 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.059 178.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.453 ' HD3' ' O ' ' A' 3620 ' ' ASN . 87.5 Cg_endo -80.5 26.6 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 123.436 2.757 . . . . 0.0 112.802 -178.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -75.76 34.93 0.12 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -175.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.541 ' HE2' HD22 ' A' 3616 ' ' ASN . 60.0 m-85 -128.49 133.95 48.6 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.487 174.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.466 HG13 HD13 ' A' 3611 ' ' ILE . 4.1 t -126.05 113.89 36.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.095 177.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.611 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.4 mp -98.84 112.46 24.55 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.459 ' O ' ' HA ' ' A' 3659 ' ' ILE . 33.9 mt-30 -95.14 111.15 23.01 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.9 -176.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.57 HG12 HG12 ' A' 3659 ' ' ILE . 39.9 mt -93.12 99.12 9.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.628 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3629 ' ' PHE . . . . . 0.516 ' HB2' ' HE3' ' A' 3658 ' ' MET . 97.3 m-85 -89.71 145.21 33.04 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.005 178.371 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.32 169.37 18.5 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.427 2.085 . . . . 0.0 111.243 173.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.08 48.23 0.85 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.185 2.59 . . . . 0.0 112.576 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.9 p -74.72 163.4 27.73 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.374 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -47.43 -47.56 26.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.71 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 30.1 t80 -47.06 -48.11 22.52 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.414 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3635 ' ' SER . . . . . 0.494 ' HA ' ' HE1' ' A' 3658 ' ' MET . 20.6 t -59.26 -58.8 7.06 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.978 -178.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -66.76 -35.22 79.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.336 -171.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 62.0 m -58.18 -57.77 11.39 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 120.867 0.365 . . . . 0.0 110.725 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3638 ' ' HIS . . . . . 0.457 ' HE2' ' CE ' ' A' 3658 ' ' MET . 10.2 p80 -69.42 -26.14 64.47 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 120.145 -0.622 . . . . 0.0 110.721 -177.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 50.2 mt -64.42 -35.27 80.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.843 0.354 . . . . 0.0 110.375 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.923 ' HA ' HD23 ' A' 3647 ' ' LEU . 16.6 m -67.78 -39.01 84.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.232 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -78.18 -24.06 47.34 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.491 -177.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.587 HD12 HD23 ' A' 3575 ' ' LEU . 17.4 mt -101.13 -41.0 6.91 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -172.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.553 ' HB3' ' CZ ' ' A' 3505 ' ' TYR . . . -147.09 89.11 5.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.751 0.31 . . . . 0.0 111.687 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -78.14 -16.78 13.82 Favored 'Trans proline' 0 CA--C 1.534 0.475 0 C-N-CA 122.608 2.205 . . . . 0.0 113.974 -175.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 6.8 t0 -76.08 -53.4 8.39 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -177.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.692 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -73.13 -28.02 62.01 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 179.82 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.923 HD23 ' HA ' ' A' 3640 ' ' SER . 24.3 tp -52.15 -52.88 49.08 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.061 0.458 . . . . 0.0 111.04 175.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.23 -17.95 63.01 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.254 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.633 ' HB3' HG11 ' A' 3496 ' ' VAL . 11.0 m -87.39 -37.34 17.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.474 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.549 ' HA ' ' CG2' ' A' 3653 ' ' ILE . 3.5 pt -79.4 -12.13 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.863 0.363 . . . . 0.0 111.392 -178.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 19.7 m -55.05 -37.97 67.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.485 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 8.8 t30 -80.16 -33.5 38.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.841 0.353 . . . . 0.0 110.743 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.549 ' CG2' ' HA ' ' A' 3650 ' ' ILE . 8.6 tp -104.01 39.67 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 122.585 1.184 . . . . 0.0 109.279 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.437 ' N ' ' HD2' ' A' 3655 ' ' PRO . 47.0 t -33.92 -46.03 0.63 Allowed Pre-proline 0 CA--C 1.541 0.604 0 CA-C-N 113.582 -1.644 . . . . 0.0 113.286 169.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.44 ' HG2' HD13 ' A' 3653 ' ' ILE . 19.8 Cg_endo -61.17 79.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.519 1.479 . . . . 0.0 111.776 170.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 31.5 p80 -143.78 170.31 16.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.999 -178.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.575 HD11 HD13 ' A' 3595 ' ' LEU . 69.2 mt -115.38 143.38 45.37 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.526 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3658 ' ' MET . . . . . 0.516 ' HE3' ' HB2' ' A' 3629 ' ' PHE . 8.7 tmm? -110.48 111.26 22.39 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 177.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.57 HG12 HG12 ' A' 3628 ' ' ILE . 70.3 mt -107.95 122.52 62.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.652 -170.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.674 HG13 ' HD2' ' A' 3573 ' ' TYR . 72.3 t -106.27 116.47 50.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.005 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.627 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 54.0 mt -91.0 113.12 26.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.213 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.81 128.92 56.26 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.107 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 13.7 m -76.14 132.12 39.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.955 174.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.441 -0.79 . . . . 0.0 109.696 175.677 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.577 ' CD2' ' HB2' ' A' 3553 ' ' MET . 13.2 m-85 . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 120.36 0.124 . . . . 0.0 111.238 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.643 ' HG2' ' H ' ' B' 2520 ' ' THR . 14.5 tt0 55.09 -157.28 0.22 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 2520 ' ' THR . . . . . 0.643 ' H ' ' HG2' ' B' 2519 ' ' GLU . 85.3 m -155.53 121.26 5.01 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 174.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.597 HD21 ' H ' ' B' 2522 ' ' SEP . 0.5 OUTLIER -79.58 -120.37 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.713 -179.414 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.683 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 2523 ' ' ASP . . . . . 0.465 ' CG ' ' H ' ' B' 2524 ' ' SEP . 8.6 t70 -149.94 -158.45 0.92 Allowed 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -178.466 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B 2524 ' ' SEP . . . . . 0.465 ' H ' ' CG ' ' B' 2523 ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 30.3 tt0 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.318 -0.848 . . . . 0.0 109.814 179.023 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A 3496 ' ' VAL . . . . . 0.412 ' HB ' ' OG ' ' A' 3649 ' ' SER . 30.6 m . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 120.778 0.323 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 16.9 t70 -105.56 112.84 26.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.082 0.468 . . . . 0.0 110.523 -179.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 4.6 mpp? -81.9 -20.57 38.5 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.623 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.482 ' HA ' HD11 ' A' 3502 ' ' LEU . 34.6 t -62.62 -24.66 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.043 -177.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -74.97 -59.41 2.75 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.072 0.463 . . . . 0.0 110.865 173.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.543 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp -69.42 -32.51 71.53 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -169.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.608 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.17 -15.68 62.98 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.239 -173.852 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.608 ' N ' HD13 ' A' 3502 ' ' LEU . 49.6 tptt -67.05 -30.58 70.69 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 177.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 17.1 tptm -96.37 -39.68 9.49 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.399 178.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.682 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -151.4 106.97 2.94 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 121.454 0.645 . . . . 0.0 111.148 178.756 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 3506 ' ' PRO . . . . . 0.595 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 97.5 Cg_endo -86.35 174.41 6.05 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 124.184 3.256 . . . . 0.0 113.937 -177.747 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.503 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 94.4 mt -71.4 135.41 28.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.259 -178.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3508 ' ' VAL . . . . . 0.487 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.4 m -102.46 -29.9 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.325 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.573 ' CB ' HD12 ' A' 3538 ' ' LEU . 39.9 t-105 -150.07 154.66 38.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.286 -178.32 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -150.52 119.14 6.51 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.3 -125.06 0.78 Allowed Glycine 0 N--CA 1.443 -0.881 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 -176.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.63 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.5 mp -141.44 158.57 43.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.087 0.47 . . . . 0.0 111.178 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.462 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 81.8 mt -113.24 150.25 32.64 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 169.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.574 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.21 125.62 13.97 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -177.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.581 HD11 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.39 138.71 38.5 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 171.944 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.581 ' HD3' HD11 ' A' 3515 ' ' LEU . 0.3 OUTLIER 59.97 -96.31 0.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.537 0.523 . . . . 0.0 110.122 -170.644 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -138.06 9.33 2.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.579 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -100.28 125.71 46.51 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.857 -177.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.445 HG21 ' HB1' ' A' 3514 ' ' ALA . 38.6 p -117.73 134.83 54.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.563 177.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -129.86 122.51 28.81 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.63 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.67 119.42 17.87 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.076 0.465 . . . . 0.0 110.133 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' 3579 ' ' LEU . 35.0 m -130.44 147.98 33.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.596 0.712 . . . . 0.0 112.061 -175.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -108.89 126.02 52.62 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.043 172.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.581 HD23 HD12 ' A' 3576 ' ' LEU . 1.2 mt -94.83 110.31 22.19 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.736 -176.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.503 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 79.2 m-70 -86.71 138.96 31.21 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.03 -0.986 . . . . 0.0 108.878 176.166 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.682 ' O ' ' HB2' ' A' 3505 ' ' TYR . 69.1 t80 -68.99 137.91 54.1 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 173.589 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.624 ' CG1' HD21 ' A' 3575 ' ' LEU . 23.3 t -114.61 -56.51 4.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 CA-C-O 121.474 0.654 . . . . 0.0 110.664 176.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.431 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 73.8 m -160.83 171.84 18.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.997 -172.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 90.12 -150.95 21.25 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.897 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.546 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.7 t-20 -101.53 111.73 24.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.955 0.407 . . . . 0.0 111.099 -177.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.2 p30 -62.31 -30.67 71.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.482 -177.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3532 ' ' VAL . . . . . 0.562 ' O ' ' HG2' ' A' 3536 ' ' ARG . 62.1 t -61.08 -35.57 66.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.491 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.407 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 29.7 mt -55.98 -40.45 73.31 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.929 177.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.403 ' HB2' ' CD1' ' A' 3538 ' ' LEU . . . -70.19 -37.14 75.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.994 0.426 . . . . 0.0 110.693 -179.504 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -61.5 -39.34 90.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.892 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3536 ' ' ARG . . . . . 0.562 ' HG2' ' O ' ' A' 3532 ' ' VAL . 12.5 ptp180 -88.7 -21.39 23.91 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -177.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.517 ' HB2' HD13 ' A' 3626 ' ' LEU . 58.0 p -90.17 -43.31 10.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.71 0.291 . . . . 0.0 111.508 -178.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.573 HD12 ' CB ' ' A' 3509 ' ' TRP . 25.2 mt -78.65 113.59 36.14 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -174.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -78.18 146.51 22.64 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 123.174 2.583 . . . . 0.0 113.258 -170.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 1.5 pt? -165.37 169.53 15.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.061 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 23.0 t 175.26 -42.86 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 -178.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -151.74 136.68 17.26 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.642 175.679 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 63.56 -108.36 2.17 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.515 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -175.45 97.19 0.11 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.445 -0.662 . . . . 0.0 111.445 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -61.94 146.44 96.36 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 123.295 2.663 . . . . 0.0 112.723 -177.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.609 ' HA ' ' O ' ' A' 3512 ' ' LEU . 93.2 Cg_endo -84.23 126.48 3.74 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.676 2.251 . . . . 0.0 112.232 177.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.559 ' HB3' HD11 ' A' 3612 ' ' ILE . 28.6 mt -69.24 113.22 6.39 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.795 175.509 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.628 ' HD2' ' OD2' ' B' 2523 ' ' ASP . 40.4 ptt85 -91.41 135.76 33.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.936 0.398 . . . . 0.0 110.842 -175.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.548 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.2 mt -91.61 107.87 19.31 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-O 122.211 1.005 . . . . 0.0 111.021 -177.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.43 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -115.21 2.32 14.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.179 -0.918 . . . . 0.0 111.562 -175.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.691 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 73.9 mt-30 -151.54 171.94 16.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.581 0.229 . . . . 0.0 110.98 178.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.691 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.28 138.34 16.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.013 0.435 . . . . 0.0 111.322 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.54 ' HB3' ' HB1' ' A' 3609 ' ' ALA . 17.9 ttt -109.49 124.88 51.81 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.467 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -65.75 110.79 2.94 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.37 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.562 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -75.13 97.95 3.58 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 122.32 1.057 . . . . 0.0 108.965 178.101 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.633 ' HB2' ' HG2' ' A' 3559 ' ' GLN . 58.2 mm-40 -113.18 165.43 12.41 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.821 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.483 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.31 -51.87 65.31 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.319 0.387 . . . . 0.0 111.098 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 41.5 p -62.09 -33.15 73.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.073 0.463 . . . . 0.0 110.908 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.633 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 32.1 mm-40 -73.88 -44.43 55.35 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.047 -176.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.523 HD22 ' HB2' ' A' 3555 ' ' LEU . 83.0 mt -64.11 -32.56 74.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.254 -176.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' 3557 ' ' ALA . 8.0 mm-40 -69.23 -44.02 72.84 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3562 ' ' GLY . . . . . 0.404 ' O ' ' HB3' ' A' 3565 ' ' ARG . . . -59.49 -40.03 95.7 Favored Glycine 0 CA--C 1.52 0.357 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.312 176.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.552 HG23 ' O ' ' A' 3559 ' ' GLN . 62.7 t -62.51 -48.02 90.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 175.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3564 ' ' ALA . . . . . 0.518 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.44 -32.3 70.08 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.113 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.498 ' O ' HG22 ' A' 3568 ' ' THR . 43.4 ttm180 -57.82 -46.26 84.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.81 177.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -87.05 -5.32 59.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.936 0.398 . . . . 0.0 111.297 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.518 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 82.5 mtp -88.65 -21.12 24.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.959 176.167 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3568 ' ' THR . . . . . 0.498 HG22 ' O ' ' A' 3565 ' ' ARG . 3.3 t -74.59 -14.34 60.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.84 0.352 . . . . 0.0 111.186 -174.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 99.2 t -114.4 101.98 13.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.113 0.482 . . . . 0.0 110.412 178.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -73.99 108.32 6.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.546 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.5 m 151.47 -39.96 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.45 1.5 . . . . 0.0 108.082 -174.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -82.46 -26.37 32.71 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.523 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.72 ' HD2' HG12 ' A' 3660 ' ' VAL . 0.2 OUTLIER -135.36 169.06 18.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.294 179.061 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.574 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 34.5 t -130.1 136.56 49.46 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 171.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.624 HD21 ' CG1' ' A' 3527 ' ' VAL . 13.1 tp -106.54 125.98 51.69 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.581 HD12 HD23 ' A' 3524 ' ' LEU . 79.5 mt -127.53 157.05 41.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.175 0.512 . . . . 0.0 111.022 -177.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.622 ' HG ' HD12 ' A' 3646 ' ' LEU . 0.4 OUTLIER -124.03 109.43 13.51 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.173 179.079 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.456 ' HB1' HD13 ' A' 3659 ' ' ILE . . . -95.1 123.36 38.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.277 0.561 . . . . 0.0 110.584 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.448 ' HG ' HD11 ' A' 3577 ' ' LEU . 69.0 mt -124.02 144.83 46.25 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.09 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.83 112.51 1.66 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.402 2.068 . . . . 0.0 111.955 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.9 p -96.74 108.31 20.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.222 0.534 . . . . 0.0 110.657 -177.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.06 146.79 16.67 Favored Glycine 0 N--CA 1.442 -0.93 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.059 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -68.31 -36.68 79.68 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.682 0.753 . . . . 0.0 109.46 179.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.604 ' O ' HG23 ' A' 3588 ' ' VAL . 17.1 t70 -129.72 164.71 23.4 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.311 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3585 ' ' GLN . . . . . 0.429 ' O ' HG23 ' A' 3589 ' ' VAL . 23.7 tp60 -56.61 -39.39 73.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.887 0.375 . . . . 0.0 110.374 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -64.58 -44.89 89.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.144 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.405 ' HB3' ' H ' ' A' 3584 ' ' ASP . 30.0 t70 -60.59 -43.16 97.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.308 178.553 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' 3584 ' ' ASP . 98.4 t -56.04 -47.99 79.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.215 177.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3589 ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' 3585 ' ' GLN . 80.4 t -60.06 -47.23 92.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.293 178.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 42.3 t -60.73 -42.06 96.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.061 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -69.55 -36.06 76.0 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.001 -0.279 . . . . 0.0 110.661 177.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 85.6 m -62.25 -53.17 58.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.697 178.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.57 -34.15 77.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.18 -178.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.6 m -69.35 -46.12 67.77 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.884 0.374 . . . . 0.0 110.259 177.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.539 HD12 HD13 ' A' 3657 ' ' LEU . 63.9 tp -64.36 -43.55 94.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.958 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.799 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.1 OUTLIER -66.3 -32.87 74.54 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.958 -177.002 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.56 -37.58 22.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.795 0.331 . . . . 0.0 111.404 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3598 ' ' ALA . . . . . 0.559 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -88.95 -45.91 9.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -172.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.705 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 19.7 m-85 -99.73 -50.08 4.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.671 0.272 . . . . 0.0 111.542 -176.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.799 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 24.0 mm -62.04 -60.28 2.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.131 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 91.2 m -56.96 -42.44 80.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.147 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.705 ' HD2' ' HA ' ' A' 3599 ' ' PHE . 0.0 OUTLIER -63.52 -53.37 52.99 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.542 0.211 . . . . 0.0 110.826 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.699 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -66.73 -36.22 81.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.916 0.389 . . . . 0.0 110.916 -170.916 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -73.87 -36.35 64.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.075 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -71.46 -34.56 70.32 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.786 0.327 . . . . 0.0 110.911 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3606 ' ' LYS . . . . . 0.578 ' HG2' ' O ' ' A' 3602 ' ' TYR . 66.5 mmtt -73.92 -18.17 60.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 177.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3607 ' ' GLN . . . . . 0.501 ' O ' ' HG ' ' A' 3555 ' ' LEU . 21.1 mt-30 55.05 43.61 29.44 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -172.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3608 ' ' ALA . . . . . 0.522 ' HB3' ' HB2' ' A' 3552 ' ' ARG . . . -132.62 172.06 13.02 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.541 -170.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.691 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -107.95 118.67 37.35 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.354 172.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -63.01 103.6 0.67 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.211 177.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.691 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 32.7 mm -90.01 126.69 42.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 121.188 0.518 . . . . 0.0 110.924 -175.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.559 HD11 ' HB3' ' A' 3547 ' ' LEU . 39.7 mt -125.94 115.07 41.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.882 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3613 ' ' ASN . . . . . 0.425 ' HA ' ' O ' ' A' 3624 ' ' TYR . 6.9 m120 -90.09 119.75 30.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.0 179.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.561 ' O ' ' HA ' ' A' 3622 ' ' PRO . 30.2 m -115.54 143.1 29.89 Favored Pre-proline 0 C--N 1.316 -0.859 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.863 -178.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.624 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 93.2 Cg_endo -91.72 137.12 1.87 Allowed 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 122.452 2.101 . . . . 0.0 112.48 174.402 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.409 ' OD1' ' HB2' ' A' 3619 ' ' SER . 3.8 t-20 -95.15 106.25 24.56 Favored Pre-proline 0 C--N 1.315 -0.903 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 176.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -31.41 88.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 125.16 3.907 . . . . 0.0 115.083 -168.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 52.74 18.25 5.45 Favored Glycine 0 C--N 1.335 0.522 0 CA-C-N 115.411 -0.813 . . . . 0.0 114.126 177.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3619 ' ' SER . . . . . 0.409 ' HB2' ' OD1' ' A' 3616 ' ' ASN . 18.8 m -108.13 -35.86 6.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.315 0.558 . . . . 0.0 112.282 -175.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 63.7 t30 -153.36 13.82 0.5 Allowed 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.141 -0.623 . . . . 0.0 111.827 -174.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.765 ' HB3' ' HD2' ' A' 3622 ' ' PRO . 2.3 mp0 68.1 175.02 0.08 OUTLIER Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.822 174.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.765 ' HD2' ' HB3' ' A' 3621 ' ' GLN . 61.3 Cg_endo -73.96 25.46 0.33 Allowed 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 123.41 2.74 . . . . 0.0 113.921 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -76.51 43.73 0.33 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.957 0.408 . . . . 0.0 111.558 -178.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.491 ' OH ' ' HD3' ' A' 3536 ' ' ARG . 78.9 m-85 -128.63 132.83 48.15 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-O 121.031 0.443 . . . . 0.0 110.587 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.424 HG12 ' HG3' ' A' 3627 ' ' GLN . 5.7 t -119.37 114.7 45.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.99 178.501 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.606 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -96.27 110.93 23.15 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.307 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.469 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 18.3 mt-30 -94.44 110.43 22.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.826 -178.145 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.573 HG12 HG12 ' A' 3659 ' ' ILE . 35.6 mt -92.14 99.27 9.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.97 141.6 29.68 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.038 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -67.33 165.39 27.07 Favored 'Trans proline' 0 CA--C 1.53 0.309 0 C-N-CA 122.591 2.194 . . . . 0.0 111.233 175.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -69.28 77.93 0.87 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.535 2.157 . . . . 0.0 111.876 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.429 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.5 p -112.25 163.7 14.07 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.689 -174.745 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3633 ' ' GLU . . . . . 0.445 ' H ' ' CD ' ' A' 3633 ' ' GLU . 1.6 mp0 -46.47 -42.75 15.94 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.545 175.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 42.5 t80 -52.27 -52.12 54.55 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.451 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 55.1 p -69.69 -51.18 36.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.693 -177.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3636 ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' 3632 ' ' CYS . 13.3 mm-40 -60.35 -44.1 95.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.781 0.324 . . . . 0.0 111.361 -175.099 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 37.9 t -63.32 -39.51 94.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.192 0.52 . . . . 0.0 110.456 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 32.3 m80 -73.84 -33.07 63.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.66 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 75.8 mt -68.33 -37.22 80.34 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.407 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.459 ' CA ' ' HG ' ' A' 3647 ' ' LEU . 21.3 p -72.08 -31.1 65.78 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.255 0.55 . . . . 0.0 110.318 176.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3641 ' ' ARG . . . . . 0.482 ' HA ' ' CZ ' ' A' 3641 ' ' ARG . 1.2 tpm_? -76.04 -30.7 58.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.035 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.592 HD13 HD22 ' A' 3575 ' ' LEU . 16.4 mt -103.71 -32.65 9.27 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -172.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.421 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -148.7 72.74 10.59 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -175.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.57 -22.17 58.69 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 122.494 2.13 . . . . 0.0 111.764 179.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3645 ' ' ASP . . . . . 0.425 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 12.1 m-20 -70.1 -45.92 65.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.901 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.622 HD12 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -84.95 -30.74 24.04 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.575 176.73 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.459 ' HG ' ' CA ' ' A' 3640 ' ' SER . 3.4 tm? -54.19 -48.65 70.73 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.968 -179.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.66 -18.44 59.54 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.845 0.355 . . . . 0.0 111.67 -176.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3649 ' ' SER . . . . . 0.412 ' OG ' ' HB ' ' A' 3496 ' ' VAL . 6.4 t -89.73 -38.28 13.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.189 179.117 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.515 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.1 pt -76.59 -13.32 14.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -175.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.7 m -63.22 -17.65 62.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.953 0.406 . . . . 0.0 110.756 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 8.3 t30 -88.33 -36.71 16.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.171 0.51 . . . . 0.0 109.888 173.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.515 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -104.85 41.93 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-O 122.41 1.1 . . . . 0.0 109.327 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.449 ' N ' ' HD2' ' A' 3655 ' ' PRO . 66.5 m -33.47 -45.7 0.53 Allowed Pre-proline 0 CA--C 1.539 0.536 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.83 170.127 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.498 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.2 Cg_endo -59.4 84.42 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.511 1.474 . . . . 0.0 111.562 169.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -150.74 170.93 18.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.434 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.539 HD13 HD12 ' A' 3595 ' ' LEU . 43.8 mt -123.17 136.32 54.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.559 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 14.5 tmm? -102.7 111.81 24.3 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.573 HG12 HG12 ' A' 3628 ' ' ILE . 70.8 mt -107.31 119.74 57.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.276 0.56 . . . . 0.0 111.529 -170.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.72 HG12 ' HD2' ' A' 3573 ' ' TYR . 81.0 t -102.93 116.5 46.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.77 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.606 HG12 ' HG ' ' A' 3626 ' ' LEU . 55.1 mt -91.05 112.46 25.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 176.016 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -115.16 133.67 55.83 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.433 -177.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.9 m -67.82 110.05 3.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.7 171.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.25 1.084 0 C-N-CA 124.679 1.192 . . . . 0.0 112.75 -174.364 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.48 ' CD1' ' HB2' ' A' 3553 ' ' MET . 40.9 m-85 . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 119.833 -0.127 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.567 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.5 OUTLIER 54.54 -163.11 0.12 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.589 0.709 . . . . 0.0 111.948 178.237 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 10.8 p -145.47 116.15 7.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.413 167.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.548 HD22 ' CG2' ' A' 3549 ' ' ILE . 3.1 tp -76.72 -126.9 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.254 -178.331 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.542 ' HB2' ' HD2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B 2523 ' ' ASP . . . . . 0.628 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 9.1 t70 -176.91 -57.75 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.567 -175.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 14.9 tp10 . . . . . 0 C--O 1.246 0.898 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.689 174.347 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A 3496 ' ' VAL . . . . . . . . . . . . . 20.6 m . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 120.891 0.377 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -65.19 112.74 3.56 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.188 0.518 . . . . 0.0 111.078 -176.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 71.2 mtm -76.12 -13.72 60.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.193 -179.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3499 ' ' VAL . . . . . 0.406 ' HA ' HD13 ' A' 3502 ' ' LEU . 51.3 t -62.82 -23.3 32.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.627 176.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -76.32 -59.15 2.89 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.205 0.526 . . . . 0.0 110.476 176.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3501 ' ' LEU . . . . . 0.479 HD11 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp -68.41 -32.88 73.25 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -170.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3502 ' ' LEU . . . . . 0.592 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -68.94 -14.79 63.25 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.339 -174.567 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 3503 ' ' LYS . . . . . 0.577 ' N ' HD11 ' A' 3502 ' ' LEU . 12.2 tmtt? -66.6 -28.99 68.94 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 176.065 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -99.78 -42.88 6.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.356 177.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3505 ' ' TYR . . . . . 0.687 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.17 99.16 3.7 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 121.481 0.657 . . . . 0.0 110.781 -179.703 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 3506 ' ' PRO . . . . . 0.592 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 60.1 Cg_endo -80.29 173.65 12.25 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 123.817 3.011 . . . . 0.0 113.504 -178.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3507 ' ' ILE . . . . . 0.478 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 74.8 mt -71.31 135.73 27.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.112 -176.01 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 27.3 m -101.91 -29.14 3.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.408 -179.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3509 ' ' TRP . . . . . 0.554 ' HB2' HD11 ' A' 3538 ' ' LEU . 74.7 t-105 -151.96 155.11 37.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.641 0.258 . . . . 0.0 110.717 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -148.13 118.93 7.56 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 176.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.86 -130.24 1.15 Allowed Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3512 ' ' LEU . . . . . 0.644 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -139.71 158.05 44.74 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.966 0.412 . . . . 0.0 110.803 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3513 ' ' LEU . . . . . 0.48 ' O ' ' HA ' ' A' 3519 ' ' THR . 84.1 mt -110.47 149.65 30.0 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 170.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3514 ' ' ALA . . . . . 0.626 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.3 120.96 11.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -177.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3515 ' ' LEU . . . . . 0.634 HD11 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.27 145.75 41.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 172.935 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 3516 ' ' LYS . . . . . 0.634 ' HD3' HD11 ' A' 3515 ' ' LEU . 1.3 mptp? 63.64 -95.79 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -168.633 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -145.27 9.99 1.27 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.681 174.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3518 ' ' ASP . . . . . 0.402 ' O ' ' HA ' ' A' 3514 ' ' ALA . 27.3 m-20 -97.28 129.12 44.62 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.423 -174.344 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3519 ' ' THR . . . . . 0.511 HG23 ' HB3' ' A' 3514 ' ' ALA . 31.8 p -117.1 133.58 55.82 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.14 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -126.05 120.85 31.34 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3521 ' ' ALA . . . . . 0.644 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.17 120.64 18.06 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.086 0.47 . . . . 0.0 109.947 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3522 ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' 3579 ' ' LEU . 26.8 m -129.85 147.71 33.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.625 0.726 . . . . 0.0 111.822 -175.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -110.45 124.94 52.7 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.828 173.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3524 ' ' LEU . . . . . 0.602 HD23 HD13 ' A' 3576 ' ' LEU . 0.9 OUTLIER -94.17 109.96 21.72 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.597 -175.136 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 3525 ' ' HIS . . . . . 0.478 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 65.8 m80 -87.58 138.9 31.07 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.747 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3526 ' ' PHE . . . . . 0.687 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.2 t80 -67.56 136.41 54.47 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3527 ' ' VAL . . . . . 0.618 ' CG1' HD21 ' A' 3575 ' ' LEU . 26.1 t -114.68 -55.39 4.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 121.254 0.549 . . . . 0.0 110.765 176.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3528 ' ' SER . . . . . 0.496 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 72.9 m -162.01 172.53 15.8 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.948 -172.435 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3529 ' ' GLY . . . . . 0.416 ' HA2' ' HB3' ' A' 3570 ' ' GLU . . . 89.74 -152.21 22.29 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.338 -0.934 . . . . 0.0 112.166 178.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3530 ' ' ASN . . . . . 0.542 ' HB2' ' HA ' ' A' 3571 ' ' THR . 50.2 t30 -108.34 119.26 38.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.889 0.376 . . . . 0.0 110.463 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -63.41 -27.5 69.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.691 -177.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3532 ' ' VAL . . . . . 0.401 ' HB ' ' ND2' ' A' 3530 ' ' ASN . 62.4 t -57.86 -32.79 44.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.033 0.444 . . . . 0.0 110.649 178.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3533 ' ' LEU . . . . . 0.505 HD23 ' HD3' ' A' 3536 ' ' ARG . 28.3 mt -62.12 -40.61 96.5 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.367 178.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3534 ' ' ALA . . . . . 0.444 ' HA ' HD12 ' A' 3661 ' ' ILE . . . -65.5 -41.86 92.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.954 0.407 . . . . 0.0 110.195 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -61.03 -37.15 81.58 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.936 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3536 ' ' ARG . . . . . 0.505 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.6 ptm180 -89.78 -7.98 53.18 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3537 ' ' SER . . . . . 0.483 ' HB2' HD12 ' A' 3626 ' ' LEU . 41.1 p -105.14 -40.5 5.85 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.783 0.325 . . . . 0.0 111.621 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3538 ' ' LEU . . . . . 0.554 HD11 ' HB2' ' A' 3509 ' ' TRP . 28.2 mt -79.14 110.3 14.31 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-O 121.281 0.562 . . . . 0.0 109.708 -173.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.18 147.63 18.6 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 123.123 2.548 . . . . 0.0 113.273 -170.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3540 ' ' LEU . . . . . 0.516 ' HB3' ' CH2' ' A' 3509 ' ' TRP . 4.4 pp -137.81 162.15 34.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.932 177.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 41.2 t -178.63 -45.26 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.313 0.577 . . . . 0.0 109.584 -175.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -138.94 96.25 3.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.203 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 64.53 -90.52 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.543 -175.443 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -152.77 95.57 0.16 Allowed Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 111.004 -0.838 . . . . 0.0 111.004 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3545 ' ' PRO . . . . . 0.435 ' CD ' ' HA ' ' A' 3540 ' ' LEU . 31.9 Cg_exo -60.12 149.29 85.67 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 123.426 2.75 . . . . 0.0 113.144 -176.739 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3546 ' ' PRO . . . . . 0.562 ' HA ' ' O ' ' A' 3512 ' ' LEU . 87.4 Cg_endo -80.71 141.37 13.62 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.761 2.308 . . . . 0.0 112.733 179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3547 ' ' LEU . . . . . 0.565 ' HB3' HD12 ' A' 3612 ' ' ILE . 30.3 mt -85.95 115.24 23.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.131 176.13 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3548 ' ' ARG . . . . . 0.626 ' HA ' ' O ' ' A' 3514 ' ' ALA . 37.7 ptt85 -91.35 140.76 29.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.19 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3549 ' ' ILE . . . . . 0.485 HD11 HD23 ' A' 3515 ' ' LEU . 17.3 mt -96.14 107.26 19.45 Favored 'Isoleucine or valine' 0 C--O 1.249 1.045 0 CA-C-O 122.5 1.143 . . . . 0.0 111.458 -177.364 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3550 ' ' ALA . . . . . 0.521 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -114.94 4.63 14.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.92 -172.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3551 ' ' GLN . . . . . 0.718 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 62.6 mt-30 -155.0 167.22 31.08 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.469 0.308 . . . . 0.0 110.804 177.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3552 ' ' ARG . . . . . 0.684 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -149.03 134.04 18.11 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.072 0.463 . . . . 0.0 111.228 177.508 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 3553 ' ' MET . . . . . 0.565 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 14.6 tmm? -108.76 116.34 31.79 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.329 178.609 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -65.25 110.24 2.51 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3555 ' ' LEU . . . . . 0.627 HD13 ' O ' ' A' 3555 ' ' LEU . 2.1 pp -69.67 98.71 1.21 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.053 0.93 . . . . 0.0 110.233 -175.345 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3556 ' ' GLU . . . . . 0.615 ' O ' ' HG ' ' A' 3560 ' ' LEU . 37.4 mt-10 -107.67 167.11 10.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.567 177.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3557 ' ' ALA . . . . . 0.497 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -57.71 -48.19 80.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.902 0.382 . . . . 0.0 110.238 178.799 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 1.7 p -62.29 -34.01 75.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.715 178.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3559 ' ' GLN . . . . . 0.538 ' O ' HG23 ' A' 3563 ' ' VAL . 86.8 mm-40 -74.38 -40.04 62.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.868 -179.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3560 ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' A' 3556 ' ' GLU . 74.9 mt -63.98 -34.18 77.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.4 179.093 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3561 ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.1 mm-40 -61.71 -45.6 93.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.13 0.49 . . . . 0.0 109.982 174.041 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -58.06 -44.96 94.43 Favored Glycine 0 N--CA 1.453 -0.186 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.214 175.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3563 ' ' VAL . . . . . 0.614 ' O ' ' HG3' ' A' 3567 ' ' MET . 40.2 t -61.83 -50.52 79.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.823 0.344 . . . . 0.0 110.28 177.009 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -58.45 -31.89 68.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.695 -178.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3565 ' ' ARG . . . . . 0.482 ' O ' HG22 ' A' 3568 ' ' THR . 31.6 ttp85 -54.3 -46.21 72.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.745 178.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3566 ' ' ARG . . . . . 0.404 ' HG2' ' O ' ' A' 3563 ' ' VAL . 16.9 ptt-85 -86.63 -12.74 47.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.872 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3567 ' ' MET . . . . . 0.614 ' HG3' ' O ' ' A' 3563 ' ' VAL . 86.3 mtp -78.25 -27.02 47.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 110.742 178.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3568 ' ' THR . . . . . 0.482 HG22 ' O ' ' A' 3565 ' ' ARG . 7.7 t -82.91 1.34 39.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.197 0.522 . . . . 0.0 110.276 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 51.7 t -128.42 87.41 1.08 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.689 176.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3570 ' ' GLU . . . . . 0.416 ' HB3' ' HA2' ' A' 3529 ' ' GLY . 49.3 mt-10 -70.4 109.21 4.63 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -179.1 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3571 ' ' THR . . . . . 0.542 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.4 m 151.17 -38.53 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.418 1.487 . . . . 0.0 108.438 -176.404 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -82.36 -29.98 30.62 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.263 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3573 ' ' TYR . . . . . 0.727 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -127.25 163.55 23.68 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.873 176.249 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 3574 ' ' CYS . . . . . 0.572 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 28.0 t -128.25 136.48 51.09 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 171.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3575 ' ' LEU . . . . . 0.618 HD21 ' CG1' ' A' 3527 ' ' VAL . 13.1 tp -106.06 125.61 51.2 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3576 ' ' LEU . . . . . 0.602 HD13 HD23 ' A' 3524 ' ' LEU . 79.7 mt -127.61 155.58 43.63 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.138 0.494 . . . . 0.0 110.825 -177.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3577 ' ' LEU . . . . . 0.704 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -123.03 107.9 12.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.387 179.776 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 3578 ' ' ALA . . . . . 0.439 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.27 123.53 37.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.325 0.584 . . . . 0.0 110.501 -177.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3579 ' ' LEU . . . . . 0.464 ' O ' ' HA ' ' A' 3522 ' ' VAL . 53.6 mt -124.29 144.24 45.13 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 114.97 -1.013 . . . . 0.0 110.328 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -60.57 113.06 1.53 Allowed 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.37 2.047 . . . . 0.0 111.452 177.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.2 p -99.28 107.79 20.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.349 0.595 . . . . 0.0 110.362 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3582 ' ' GLY . . . . . 0.426 ' HA2' ' OD2' ' A' 3587 ' ' ASP . . . -98.28 145.6 17.83 Favored Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.563 179.432 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3583 ' ' ARG . . . . . 0.404 ' HG2' ' OD2' ' A' 3587 ' ' ASP . 27.2 mmt-85 -64.4 -43.04 95.67 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3584 ' ' ASP . . . . . 0.574 ' O ' HG23 ' A' 3588 ' ' VAL . 5.3 p-10 -134.65 -179.77 5.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.096 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -57.7 -43.6 85.28 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.102 0.251 . . . . 0.0 111.336 -175.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.33 -43.85 89.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.345 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3587 ' ' ASP . . . . . 0.426 ' OD2' ' HA2' ' A' 3582 ' ' GLY . 26.8 t70 -60.84 -44.67 96.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.398 -179.172 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3588 ' ' VAL . . . . . 0.574 HG23 ' O ' ' A' 3584 ' ' ASP . 98.4 t -56.52 -39.82 64.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.71 178.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3589 ' ' VAL . . . . . 0.435 ' O ' ' HG2' ' A' 3593 ' ' GLU . 13.1 t -64.87 -51.1 71.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.582 0.706 . . . . 0.0 109.641 -179.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 34.3 m -64.32 -37.99 89.46 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.196 -177.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -71.42 -37.17 71.48 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.128 -0.358 . . . . 0.0 111.061 177.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 89.2 m -63.32 -50.07 71.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.644 0.259 . . . . 0.0 110.818 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3593 ' ' GLU . . . . . 0.512 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 8.8 pt-20 -64.2 -37.11 86.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.97 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 7.6 t -67.52 -43.12 81.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.822 0.344 . . . . 0.0 110.232 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3595 ' ' LEU . . . . . 0.557 HD11 HD11 ' A' 3657 ' ' LEU . 61.4 tp -63.42 -46.63 85.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.101 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3596 ' ' LYS . . . . . 0.819 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 57.5 pttt -67.84 -30.58 70.01 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.008 -177.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.78 -38.44 54.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.729 0.299 . . . . 0.0 111.57 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -93.91 -45.93 7.4 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -171.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3599 ' ' PHE . . . . . 0.502 ' CZ ' HD21 ' A' 3515 ' ' LEU . 12.0 m-85 -98.97 -50.07 4.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.651 0.262 . . . . 0.0 111.683 -175.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3600 ' ' ILE . . . . . 0.819 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.6 mm -61.88 -60.08 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.261 -175.597 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 74.8 m -53.29 -40.92 65.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.675 0.274 . . . . 0.0 111.089 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3602 ' ' TYR . . . . . 0.801 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -64.71 -57.07 9.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.082 179.503 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 3603 ' ' LEU . . . . . 0.801 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.1 OUTLIER -57.99 -41.62 83.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.644 0.259 . . . . 0.0 111.43 -177.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -72.66 -36.09 67.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.567 -176.736 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.74 68.44 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.942 0.401 . . . . 0.0 110.961 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -81.2 -19.1 44.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.78 177.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3607 ' ' GLN . . . . . 0.543 ' O ' ' HG ' ' A' 3555 ' ' LEU . 46.3 mt-30 50.39 52.06 15.57 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -171.003 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3608 ' ' ALA . . . . . . . . . . . . . . . -135.45 -176.19 4.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.193 -171.168 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3609 ' ' ALA . . . . . 0.684 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.4 117.97 29.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.537 176.452 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3610 ' ' GLY . . . . . 0.402 ' N ' HD12 ' A' 3603 ' ' LEU . . . -65.24 102.4 0.66 Allowed Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.244 -0.742 . . . . 0.0 111.244 177.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3611 ' ' ILE . . . . . 0.718 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 32.4 mm -89.3 126.18 42.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-O 121.201 0.525 . . . . 0.0 110.762 -175.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3612 ' ' ILE . . . . . 0.565 HD12 ' HB3' ' A' 3547 ' ' LEU . 34.1 mt -122.07 112.92 36.74 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.221 177.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 15.5 m120 -84.64 111.7 19.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.121 -179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3614 ' ' VAL . . . . . 0.487 ' O ' ' HA ' ' A' 3622 ' ' PRO . 34.8 m -109.47 144.66 30.29 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.662 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3615 ' ' PRO . . . . . 0.45 ' HA ' ' O ' ' A' 3621 ' ' GLN . 97.7 Cg_endo -92.68 140.46 1.96 Allowed 'Trans proline' 0 N--CA 1.444 -1.398 0 C-N-CA 122.4 2.067 . . . . 0.0 112.118 173.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3616 ' ' ASN . . . . . 0.488 ' HB2' ' CE2' ' A' 3624 ' ' TYR . 25.3 t-20 -79.8 118.92 74.9 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.4 178.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -50.72 124.96 14.56 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 123.011 2.474 . . . . 0.0 112.103 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 106.47 -50.13 0.83 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.917 -0.658 . . . . 0.0 111.719 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 15.3 m -91.37 -29.06 17.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.175 0.512 . . . . 0.0 110.144 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 3.2 m-20 62.63 17.71 9.93 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.018 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3621 ' ' GLN . . . . . 0.45 ' O ' ' HA ' ' A' 3615 ' ' PRO . 78.6 mt-30 -82.53 120.3 76.42 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.028 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3622 ' ' PRO . . . . . 0.487 ' HA ' ' O ' ' A' 3614 ' ' VAL . 91.4 Cg_endo -80.8 24.79 0.65 Allowed 'Trans proline' 0 C--O 1.233 0.253 0 C-N-CA 123.405 2.736 . . . . 0.0 112.444 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -77.77 44.54 0.46 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.175 0.512 . . . . 0.0 111.651 -176.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3624 ' ' TYR . . . . . 0.488 ' CE2' ' HB2' ' A' 3616 ' ' ASN . 80.7 m-85 -134.82 133.04 39.35 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.962 177.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3625 ' ' VAL . . . . . 0.44 HG12 HG23 ' A' 3611 ' ' ILE . 3.1 t -118.97 115.57 48.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.067 179.262 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3626 ' ' LEU . . . . . 0.611 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -97.82 113.79 25.68 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 169.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3627 ' ' GLN . . . . . 0.561 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 95.0 mt-30 -94.48 111.42 23.17 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.225 -178.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3628 ' ' ILE . . . . . 0.58 HG12 HG12 ' A' 3659 ' ' ILE . 40.9 mt -92.08 98.22 8.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.034 178.265 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -88.96 141.94 29.94 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.855 178.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3630 ' ' PRO . . . . . 0.598 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.6 Cg_endo -70.83 169.24 20.75 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 122.487 2.125 . . . . 0.0 111.414 176.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -68.0 74.31 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.684 2.256 . . . . 0.0 111.833 176.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3632 ' ' CYS . . . . . 0.578 ' O ' ' HG2' ' A' 3636 ' ' GLU . 9.0 p -111.69 163.34 14.23 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.642 -174.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -47.69 -41.66 23.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.738 177.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 39.1 t80 -53.91 -52.42 60.59 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.441 177.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 56.4 p -70.29 -53.55 16.38 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.686 -177.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3636 ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.1 mm-40 -56.21 -44.76 79.82 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 123.445 0.466 . . . . 0.0 111.072 -174.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 48.4 t -61.97 -53.11 60.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.565 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 43.2 m80 -61.62 -34.86 76.4 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.573 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.55 -31.3 71.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.315 177.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3640 ' ' SER . . . . . 0.61 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 21.8 m -71.16 -29.91 65.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.33 0.586 . . . . 0.0 110.035 -178.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -89.05 -44.57 10.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.424 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3642 ' ' LEU . . . . . 0.576 HD13 HD23 ' A' 3575 ' ' LEU . 22.8 mt -78.48 -30.85 47.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.246 -0.434 . . . . 0.0 112.17 -173.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3643 ' ' ALA . . . . . 0.426 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -150.78 69.54 8.55 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.456 0.17 . . . . 0.0 111.369 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.0 -19.39 66.4 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.417 2.078 . . . . 0.0 111.731 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3645 ' ' ASP . . . . . 0.453 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 18.1 m-20 -72.83 -51.42 18.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.204 -177.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3646 ' ' LEU . . . . . 0.704 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -79.5 -29.94 41.77 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.183 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 3647 ' ' LEU . . . . . 0.61 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -54.26 -45.72 72.48 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.424 178.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.32 -31.13 69.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.96 0.409 . . . . 0.0 111.119 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 15.3 m -76.78 -36.56 56.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.852 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3650 ' ' ILE . . . . . 0.636 ' HA ' HG21 ' A' 3653 ' ' ILE . 7.0 pt -83.5 -9.89 11.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.925 0.393 . . . . 0.0 111.293 -176.436 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 8.3 t -60.18 -25.53 65.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.329 176.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 17.9 m120 -88.01 -32.56 18.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.033 0.444 . . . . 0.0 110.305 175.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3653 ' ' ILE . . . . . 0.636 HG21 ' HA ' ' A' 3650 ' ' ILE . 0.4 OUTLIER -104.68 36.1 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-O 122.847 1.308 . . . . 0.0 109.16 -177.121 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A 3654 ' ' SER . . . . . 0.43 ' N ' ' HD2' ' A' 3655 ' ' PRO . 49.5 m -30.31 -45.61 0.26 Allowed Pre-proline 0 N--CA 1.473 0.701 0 CA-C-N 113.966 -1.47 . . . . 0.0 114.433 172.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3655 ' ' PRO . . . . . 0.544 ' HG2' HD13 ' A' 3653 ' ' ILE . 11.9 Cg_endo -58.28 80.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 121.826 1.684 . . . . 0.0 111.842 169.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -146.91 169.39 19.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.762 -176.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3657 ' ' LEU . . . . . 0.557 HD11 HD11 ' A' 3595 ' ' LEU . 50.3 mt -121.64 137.15 54.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.656 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.3 tmm? -104.39 112.55 25.64 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3659 ' ' ILE . . . . . 0.58 HG12 HG12 ' A' 3628 ' ' ILE . 73.1 mt -106.62 121.27 59.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.237 0.542 . . . . 0.0 111.59 -171.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3660 ' ' VAL . . . . . 0.727 HG13 ' HD2' ' A' 3573 ' ' TYR . 79.5 t -104.47 116.43 48.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.914 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3661 ' ' ILE . . . . . 0.611 HG12 ' HG ' ' A' 3626 ' ' LEU . 73.4 mt -91.07 115.72 30.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 176.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -122.96 133.58 54.37 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.226 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.1 m -78.49 110.19 13.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 3.4 p . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.921 -1.038 . . . . 0.0 111.262 -175.449 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B 2518 ' ' TYR . . . . . 0.565 ' CD1' ' HB2' ' A' 3553 ' ' MET . 7.6 m-85 . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 119.17 -0.443 . . . . 0.0 112.144 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 2519 ' ' GLU . . . . . 0.484 ' HG2' ' HE ' ' A' 3552 ' ' ARG . 30.6 tt0 44.49 95.94 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 172.092 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 2520 ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' 3550 ' ' ALA . 17.5 p -57.64 131.12 49.29 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 122.291 -0.256 . . . . 0.0 111.189 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 2521 ' ' LEU . . . . . 0.624 ' HG ' ' N ' ' B' 2522 ' ' SEP . 16.7 tp -81.98 -118.36 0.02 OUTLIER 'General case' 0 C--O 1.234 0.238 0 C-N-CA 121.178 -0.209 . . . . 0.0 110.558 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 2522 ' ' SEP . . . . . 0.624 ' N ' ' HG ' ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B 2523 ' ' ASP . . . . . 0.581 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 6.1 t70 -146.01 -65.63 0.3 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.886 178.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 . . . . . 0 C--O 1.247 0.966 0 CA-C-O 118.694 -0.669 . . . . 0.0 109.868 175.495 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.61 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.0 pp . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.619 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.25 -16.23 63.01 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.234 -174.969 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.619 ' N ' HD13 ' A' 3502 ' ' LEU . 73.6 mmtt -72.0 -25.05 61.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.312 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 85.3 mttt -104.41 -44.53 4.9 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.507 0.67 . . . . 0.0 110.511 177.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.756 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -142.47 94.33 6.81 Favored Pre-proline 0 N--CA 1.435 -1.191 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.192 -176.773 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -80.64 174.17 11.41 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 123.811 3.007 . . . . 0.0 113.432 -178.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.461 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.2 mt -70.57 136.81 25.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.792 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 28.6 m -108.02 -20.33 6.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.699 -177.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.788 ' HE3' HD12 ' A' 3524 ' ' LEU . 24.2 t90 -159.69 153.16 22.45 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.643 0.259 . . . . 0.0 110.388 -176.219 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 23.7 tm0? -148.27 119.9 8.02 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 177.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -172.91 -129.65 1.17 Allowed Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.743 -0.741 . . . . 0.0 111.515 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.646 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -140.01 155.86 46.89 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.073 0.463 . . . . 0.0 111.196 -179.305 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.524 HD23 ' HB2' ' A' 3547 ' ' LEU . 83.2 mt -107.63 152.43 24.3 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 168.47 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.636 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -146.86 122.47 10.46 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.089 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.598 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.89 145.21 41.86 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 171.6 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.598 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.1 OUTLIER 59.83 -96.16 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.989 0.423 . . . . 0.0 110.069 -168.352 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -143.68 8.49 1.52 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -102.35 122.42 44.22 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.14 -173.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 66.6 p -108.62 152.7 24.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.104 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -141.61 114.75 8.71 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.193 173.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.646 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -69.01 117.2 10.36 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 176.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.421 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.9 m -131.31 148.16 32.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.426 -177.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -112.57 132.88 54.91 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.042 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.891 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -100.64 113.11 25.67 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.408 0.623 . . . . 0.0 112.189 -173.087 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.461 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 83.0 m-70 -87.32 137.56 32.24 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.481 174.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.756 ' O ' ' HB2' ' A' 3505 ' ' TYR . 62.1 t80 -66.14 139.83 58.17 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 174.747 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.604 ' CG1' HD23 ' A' 3575 ' ' LEU . 16.2 t -116.62 -55.64 4.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.362 0.601 . . . . 0.0 111.304 175.132 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.426 ' HB3' ' HB3' ' A' 3575 ' ' LEU . 13.6 t -158.02 170.14 22.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.917 -169.505 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.03 -152.23 24.43 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.86 175.74 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.434 ' HB2' ' HA ' ' A' 3571 ' ' THR . 52.2 t-20 -97.95 114.58 26.73 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -64.21 -28.22 69.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.73 0.3 . . . . 0.0 111.356 -177.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 60.9 t -64.84 -31.12 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.827 0.346 . . . . 0.0 110.442 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.521 HD23 ' HD3' ' A' 3536 ' ' ARG . 18.5 mt -57.31 -39.0 74.91 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.91 176.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.458 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -70.83 -44.62 66.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.852 0.358 . . . . 0.0 110.498 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 59.0 t60 -60.76 -32.51 71.81 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.023 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.521 ' HD3' HD23 ' A' 3533 ' ' LEU . 14.1 ptm180 -89.07 -18.27 27.62 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -177.523 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.483 ' HB2' HG21 ' A' 3614 ' ' VAL . 42.3 p -98.66 -39.07 8.86 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 122.128 -0.357 . . . . 0.0 111.428 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.689 HD13 ' HB2' ' A' 3509 ' ' TRP . 30.6 mt -80.27 110.69 17.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.272 -174.066 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo . . . . . 0 N--CA 1.462 -0.325 0 C-N-CA 123.351 2.701 . . . . 0.0 112.882 -172.185 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A 3546 ' ' PRO . . . . . 0.596 ' HA ' ' O ' ' A' 3512 ' ' LEU . 15.9 Cg_endo . . . . . 0 C--O 1.234 0.289 0 CA-C-O 121.052 0.355 . . . . 0.0 112.799 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.706 ' HB3' HD13 ' A' 3612 ' ' ILE . 29.4 mt -68.92 116.4 9.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.333 177.181 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.636 ' HA ' ' O ' ' A' 3514 ' ' ALA . 16.9 ptt180 -90.35 139.07 31.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.36 -175.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.488 HD12 HD22 ' A' 3515 ' ' LEU . 31.7 mt -93.1 105.86 17.28 Favored 'Isoleucine or valine' 0 C--O 1.242 0.688 0 CA-C-O 122.066 0.936 . . . . 0.0 110.555 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -103.84 -14.56 15.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.45 -171.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.689 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 96.1 mt-30 -146.78 177.65 8.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.697 -177.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.738 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -152.82 140.95 20.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 0.0 111.689 -178.94 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.658 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 17.2 ttt -111.41 110.48 20.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.727 176.617 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -61.67 110.7 1.58 Allowed 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.505 ' O ' HD12 ' A' 3555 ' ' LEU . 2.4 pp -75.2 98.82 3.84 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.007 0.908 . . . . 0.0 110.023 -176.634 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.707 ' O ' ' HG ' ' A' 3560 ' ' LEU . 33.6 mt-10 -101.54 162.59 12.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.122 174.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.502 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -59.9 -38.02 81.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.138 0.494 . . . . 0.0 109.805 177.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 3.1 p -66.98 -41.08 87.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.162 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.676 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 77.6 mm-40 -63.68 -42.93 97.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.068 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.707 ' HG ' ' O ' ' A' 3556 ' ' GLU . 78.2 mt -60.83 -32.93 72.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.315 -178.488 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.631 ' O ' ' HD3' ' A' 3565 ' ' ARG . 10.9 mm-40 -60.95 -50.78 71.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.211 0.529 . . . . 0.0 109.72 173.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.28 -41.48 99.52 Favored Glycine 0 N--CA 1.452 -0.248 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.067 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' 3559 ' ' GLN . 69.3 t -60.47 -48.28 89.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 176.57 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.69 76.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.247 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.631 ' HD3' ' O ' ' A' 3561 ' ' GLU . 5.1 mpt_? -59.45 -41.73 90.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.236 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 24.7 ptt180 -88.2 -9.93 51.47 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.724 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.514 ' HG3' ' O ' ' A' 3563 ' ' VAL . 84.5 mtp -83.22 -29.41 28.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.939 0.4 . . . . 0.0 110.531 176.052 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3568 ' ' THR . . . . . 0.486 HG22 ' O ' ' A' 3565 ' ' ARG . 7.0 t -75.41 -15.1 60.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.065 0.46 . . . . 0.0 110.228 -178.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 46.0 t -103.12 87.0 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.958 177.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.4 107.64 6.68 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.434 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.1 m 155.68 -42.11 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 125.227 1.411 . . . . 0.0 107.662 -172.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.03 -30.91 31.23 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.48 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.854 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -126.67 164.03 22.19 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.201 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.615 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 38.3 t -127.59 135.59 50.49 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 171.511 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.789 HD22 HD13 ' A' 3642 ' ' LEU . 12.8 tp -106.27 125.8 51.44 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.613 HD11 HD11 ' A' 3661 ' ' ILE . 79.4 mt -127.59 154.66 44.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.158 0.504 . . . . 0.0 110.693 -177.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.699 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -119.75 109.76 15.99 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.135 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.527 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.55 119.74 33.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.366 0.603 . . . . 0.0 110.391 -179.206 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.492 ' HG ' HD12 ' A' 3577 ' ' LEU . 59.0 mt -119.4 142.92 33.4 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 114.721 -1.127 . . . . 0.0 109.987 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.65 113.35 1.52 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.437 2.091 . . . . 0.0 111.612 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.5 p -96.38 106.01 18.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.483 0.659 . . . . 0.0 110.448 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -102.09 147.72 17.42 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.652 178.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 48.1 ttp180 -58.75 -43.47 90.3 Favored 'General case' 0 N--CA 1.428 -1.558 0 CA-C-O 121.371 0.605 . . . . 0.0 110.421 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.631 ' O ' HG23 ' A' 3588 ' ' VAL . 3.9 p30 -142.23 177.77 8.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.012 -0.995 . . . . 0.0 108.97 178.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3585 ' ' GLN . . . . . 0.418 ' O ' HG23 ' A' 3589 ' ' VAL . 64.4 tt0 -51.93 -46.36 64.64 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.512 0.508 . . . . 0.0 111.53 -176.197 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -62.57 -46.66 87.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.409 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 22.8 t70 -60.54 -41.43 94.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.06 0.457 . . . . 0.0 110.632 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' 3584 ' ' ASP . 96.1 t -57.54 -45.27 86.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.574 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3589 ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' 3585 ' ' GLN . 83.0 t -57.76 -46.16 86.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.697 178.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 14.3 t -64.09 -42.88 96.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.724 -178.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -65.22 -39.94 93.44 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.628 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3592 ' ' THR . . . . . 0.431 ' O ' ' HG3' ' A' 3596 ' ' LYS . 31.6 m -61.85 -45.43 93.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.082 177.288 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -59.77 -50.09 75.18 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.921 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 61.3 m -61.08 -45.24 95.53 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.936 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.541 HD12 ' HB2' ' A' 3599 ' ' PHE . 44.8 tp -61.71 -45.33 94.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.072 -177.444 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.602 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 51.8 mtmt -57.95 -44.95 87.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.085 -179.615 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.88 -38.32 53.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.906 -175.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -89.69 -46.96 8.25 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -170.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.541 ' HB2' HD12 ' A' 3595 ' ' LEU . 22.9 m-85 -100.24 -50.84 3.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.721 0.296 . . . . 0.0 111.505 -175.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.602 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 32.4 mm -60.67 -58.91 5.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.841 -175.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 87.0 m -60.12 -42.57 95.06 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.363 -178.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.496 ' HE1' HD11 ' B' 2521 ' ' LEU . 40.4 t80 -65.3 -53.59 41.72 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.044 -178.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.535 HD12 ' O ' ' A' 3608 ' ' ALA . 0.3 OUTLIER -61.74 -37.15 83.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.568 0.223 . . . . 0.0 111.457 -176.599 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -76.73 -30.71 56.72 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -66.78 -36.24 81.94 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.164 0.506 . . . . 0.0 110.427 176.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -82.1 -18.49 42.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.589 178.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 50.05 54.52 10.94 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -168.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.535 ' O ' HD12 ' A' 3603 ' ' LEU . . . -136.05 -177.79 4.85 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.857 -172.195 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.738 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -116.67 120.2 37.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.959 176.226 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3610 ' ' GLY . . . . . 0.465 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.19 103.64 0.76 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 176.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.689 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 34.1 mm -89.36 117.84 33.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.239 0.542 . . . . 0.0 110.647 -174.584 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.706 HD13 ' HB3' ' A' 3547 ' ' LEU . 17.5 mt -113.74 117.2 54.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.225 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.508 ' HA ' ' O ' ' A' 3624 ' ' TYR . 87.5 m-20 -92.38 117.42 29.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.758 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.483 HG21 ' HB2' ' A' 3537 ' ' SER . 31.5 m . . . . . 0 C--N 1.32 -0.712 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.249 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.508 ' O ' ' HA ' ' A' 3613 ' ' ASN . 38.5 m-85 . . . . . 0 CA--C 1.508 -0.644 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.513 HG13 HG23 ' A' 3611 ' ' ILE . 8.1 t -116.98 114.55 46.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.612 -177.288 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.634 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -97.86 112.72 24.53 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 169.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.523 ' HB2' ' HB ' ' A' 3660 ' ' VAL . 40.5 mt-30 -94.21 110.98 22.68 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.008 -176.563 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.603 HG12 HG12 ' A' 3659 ' ' ILE . 43.5 mt -91.99 98.33 8.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.341 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -89.23 137.51 29.26 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.767 177.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.31 171.14 9.65 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.755 2.304 . . . . 0.0 111.68 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.42 52.98 2.08 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.671 2.248 . . . . 0.0 112.438 177.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 17.8 p -85.42 162.24 19.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.53 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -48.66 -45.83 39.34 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.597 0.561 . . . . 0.0 111.111 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 16.7 t80 -48.94 -46.29 43.06 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.421 177.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 7.4 m -64.67 -53.97 39.05 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.833 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -64.42 -33.13 75.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.155 -175.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 38.4 m -63.38 -48.6 77.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.106 0.479 . . . . 0.0 110.455 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -68.46 -37.66 80.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.358 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 74.0 mt -62.43 -41.76 98.95 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.667 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 5.1 p -68.35 -30.87 69.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.022 0.439 . . . . 0.0 110.831 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -79.61 -38.62 33.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.122 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.789 HD13 HD22 ' A' 3575 ' ' LEU . 19.4 mt -86.39 -37.31 18.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -144.23 74.85 15.65 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -176.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.92 -21.33 57.32 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.517 2.144 . . . . 0.0 111.828 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3645 ' ' ASP . . . . . 0.566 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.6 m-20 -73.36 -44.66 58.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.488 -177.075 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.699 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -84.5 -31.21 24.61 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 177.742 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.667 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.2 tm? -53.78 -41.31 67.07 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.577 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -64.55 -18.14 64.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.875 -178.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 72.4 m -90.38 -34.32 15.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.824 0.345 . . . . 0.0 111.024 176.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.653 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.8 pt -83.8 -13.36 11.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.688 -174.234 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 33.7 p -58.34 -28.5 65.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.059 0.457 . . . . 0.0 110.867 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -88.75 -33.09 17.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.074 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.653 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.4 tp -105.19 37.54 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 122.218 1.008 . . . . 0.0 109.398 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.491 ' N ' ' HD2' ' A' 3655 ' ' PRO . 7.9 m -35.72 -43.59 0.77 Allowed Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 114.15 -1.386 . . . . 0.0 113.916 173.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' 3654 ' ' SER . 15.0 Cg_endo -59.24 81.59 0.05 OUTLIER 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.925 1.75 . . . . 0.0 112.213 170.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3656 ' ' HIS . . . . . 0.461 ' CB ' HD23 ' A' 3579 ' ' LEU . 21.6 p-80 -155.18 179.7 8.9 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.734 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.458 HD22 HG22 ' A' 3628 ' ' ILE . 23.6 mt -122.75 147.86 46.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.768 -177.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.6 ttp -108.22 110.08 21.62 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 174.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.891 HD12 HD21 ' A' 3524 ' ' LEU . 78.2 mt -103.59 120.49 53.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.149 0.499 . . . . 0.0 111.597 -172.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.854 HG13 ' HD2' ' A' 3573 ' ' TYR . 95.6 t -105.6 115.94 48.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.995 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.634 HG12 ' HG ' ' A' 3626 ' ' LEU . 60.2 mt -90.61 112.4 24.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.315 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.6 127.85 56.22 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.985 0.422 . . . . 0.0 111.721 -175.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 22.3 m -81.24 114.39 20.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.108 170.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 52.0 t . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.326 -0.845 . . . . 0.0 109.97 -174.422 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.542 ' CD1' ' HB2' ' A' 3553 ' ' MET . 69.8 m-85 . . . . . 0 N--CA 1.48 1.037 0 CA-C-O 119.754 -0.165 . . . . 0.0 111.418 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.671 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 38.6 mt-10 53.56 -157.44 0.17 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.719 0.771 . . . . 0.0 111.348 177.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.42 ' H ' ' HB3' ' B' 2519 ' ' GLU . 33.3 m -144.81 114.09 7.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 166.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.663 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -176.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.609 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.7 pp . . . . . 0 CA--C 1.531 0.216 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.647 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.15 -15.84 63.01 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.467 -171.52 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.647 ' N ' HD13 ' A' 3502 ' ' LEU . 0.1 OUTLIER -72.17 -19.48 61.74 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.657 ' HD2' ' N ' ' A' 3504 ' ' LYS . 0.0 OUTLIER -104.84 -42.38 5.37 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.073 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.73 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.5 103.04 3.48 Favored Pre-proline 0 N--CA 1.446 -0.631 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.214 178.997 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3506 ' ' PRO . . . . . 0.444 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 98.3 Cg_endo -84.99 174.96 6.95 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 124.369 3.38 . . . . 0.0 113.726 -177.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.542 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.1 mt -71.3 136.36 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.432 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.416 HG13 ' HB2' ' A' 3526 ' ' PHE . 29.4 m -104.01 -22.85 4.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.344 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.651 ' HB2' HD13 ' A' 3538 ' ' LEU . 77.1 t-105 -157.73 150.23 22.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.734 -177.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -144.29 118.33 9.44 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.89 -129.53 1.09 Allowed Glycine 0 N--CA 1.441 -0.969 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 -177.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.622 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -141.64 151.46 43.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.186 0.517 . . . . 0.0 111.23 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.501 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.4 mt -105.2 148.79 26.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 169.443 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.673 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.55 124.95 13.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.691 0.281 . . . . 0.0 111.639 -177.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.761 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.56 142.42 41.34 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 173.839 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.761 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 60.38 -91.25 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.904 0.482 . . . . 0.0 109.98 -170.465 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -143.84 9.09 1.51 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -99.14 131.02 45.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.817 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.409 HG22 ' HB2' ' A' 3514 ' ' ALA . 31.1 p -119.54 145.28 46.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.498 -177.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -140.45 116.75 10.64 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.622 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.61 120.85 16.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.107 0.479 . . . . 0.0 110.078 177.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 27.5 m -128.87 148.57 33.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.562 0.696 . . . . 0.0 111.852 -175.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -110.31 125.48 53.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.986 -1.006 . . . . 0.0 108.621 172.333 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.849 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -96.89 107.82 20.4 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.227 0.537 . . . . 0.0 111.676 -175.378 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.542 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 62.6 m-70 -85.07 138.25 32.54 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.134 175.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.73 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.1 t80 -66.71 137.76 56.91 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 174.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.584 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.0 t -114.94 -58.11 3.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.407 0.622 . . . . 0.0 110.617 176.182 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.482 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 67.5 m -158.99 172.16 18.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.079 -170.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.13 -156.64 28.59 Favored Glycine 0 N--CA 1.453 -0.186 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.776 177.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.535 ' HB2' ' HA ' ' A' 3571 ' ' THR . 37.9 t30 -100.23 110.92 23.18 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 6.6 p30 -62.89 -26.15 68.64 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.463 -175.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3532 ' ' VAL . . . . . 0.545 ' O ' ' HG2' ' A' 3536 ' ' ARG . 80.2 t -58.4 -35.42 54.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-O 120.787 0.327 . . . . 0.0 110.418 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.559 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 40.1 mt -58.19 -42.45 86.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.031 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.449 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.09 -41.83 94.63 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.954 0.407 . . . . 0.0 110.432 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 22.8 t60 -58.7 -41.59 86.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.854 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' 3532 ' ' VAL . 14.2 ptp180 -89.5 -9.84 48.49 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.159 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.538 ' HB2' HD11 ' A' 3626 ' ' LEU . 33.7 p -99.82 -34.32 10.2 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.126 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.651 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.7 mt -81.33 104.62 3.08 Favored Pre-proline 0 C--N 1.32 -0.698 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3539 ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' 3537 ' ' SER . 57.3 Cg_endo . . . . . 0 N--CA 1.461 -0.439 0 C-N-CA 123.223 2.615 . . . . 0.0 114.763 -165.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo . . . . . 0 N--CA 1.462 -0.37 0 CA-C-O 120.831 0.263 . . . . 0.0 111.963 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.689 ' HB3' HD13 ' A' 3612 ' ' ILE . 37.5 mt -81.58 115.73 21.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.912 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' A' 3514 ' ' ALA . 29.1 ptt85 -90.45 140.46 29.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.2 -178.466 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.473 ' HA ' HG12 ' A' 3612 ' ' ILE . 17.6 mt -92.39 107.86 19.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 CA-C-O 121.944 0.878 . . . . 0.0 110.617 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.55 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.04 -3.17 14.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.064 -172.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.679 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 54.5 mt-30 -151.39 173.19 14.83 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.402 0.144 . . . . 0.0 111.127 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.681 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.42 139.65 17.54 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.847 0.356 . . . . 0.0 111.269 -179.658 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.668 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 16.5 ttt -109.17 142.67 39.64 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.101 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -77.66 110.94 12.93 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.634 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -76.86 97.76 4.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.109 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.637 ' HB2' ' HG2' ' A' 3559 ' ' GLN . 19.4 mm-40 -115.94 165.07 13.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.523 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.589 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.48 -54.6 38.8 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.176 0.297 . . . . 0.0 111.301 -178.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 27.0 p -62.48 -38.29 89.3 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 111.305 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.637 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 29.1 mm-40 -65.97 -46.86 76.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.995 -177.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' 3556 ' ' GLU . 92.0 mt -63.57 -32.01 73.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.084 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.6 mm-40 -65.34 -46.11 81.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.236 0.541 . . . . 0.0 109.952 175.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.17 99.64 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.099 176.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.532 ' O ' ' HG3' ' A' 3567 ' ' MET . 80.8 t -59.63 -45.67 94.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.903 0.382 . . . . 0.0 110.217 175.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.89 -30.04 68.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.737 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -62.35 -37.47 85.78 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -88.01 -7.79 56.56 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.646 176.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' 3563 ' ' VAL . 80.6 mtp -87.21 -24.25 24.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.619 177.591 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 31.0 p -81.87 -22.43 36.93 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.233 0.539 . . . . 0.0 110.275 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 39.7 t -93.26 80.41 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.644 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -67.21 109.2 2.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.01 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.535 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.0 m 151.77 -40.86 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.587 1.555 . . . . 0.0 108.016 -175.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -86.3 -17.51 34.41 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.689 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.778 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -136.2 163.12 31.11 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.028 0.442 . . . . 0.0 109.976 177.497 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.594 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 43.7 t -126.32 135.63 51.73 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 171.008 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.77 HD22 HD13 ' A' 3642 ' ' LEU . 14.8 tp -105.4 125.89 51.5 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.576 HD11 HD11 ' A' 3661 ' ' ILE . 73.5 mt -127.16 154.73 44.4 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.758 -177.348 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.781 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -121.78 108.84 13.97 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.959 178.825 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.521 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.75 123.16 38.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.384 0.611 . . . . 0.0 110.534 -178.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.46 HD23 ' HB2' ' A' 3656 ' ' HIS . 57.6 mt -125.28 145.57 51.19 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.205 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.22 116.02 2.98 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.415 2.077 . . . . 0.0 111.814 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.8 p -100.73 105.32 16.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.192 0.52 . . . . 0.0 110.842 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.13 145.79 16.15 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.36 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3583 ' ' ARG . . . . . 0.583 ' HG2' ' HB2' ' A' 3587 ' ' ASP . 9.0 ptp85 -61.44 -32.72 72.7 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.142 0.496 . . . . 0.0 110.993 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.609 ' O ' HG23 ' A' 3588 ' ' VAL . 2.8 p-10 -152.26 -179.45 7.55 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.799 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -49.52 -44.93 46.72 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.591 0.557 . . . . 0.0 111.479 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.93 -49.12 73.85 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 120.823 0.344 . . . . 0.0 110.773 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.583 ' HB2' ' HG2' ' A' 3583 ' ' ARG . 15.8 t0 -62.74 -42.92 99.9 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.968 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' 3584 ' ' ASP . 89.7 t -56.82 -49.35 79.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.674 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 70.9 t -62.19 -44.96 99.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.528 -179.222 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 32.6 t -61.06 -39.17 88.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.922 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3591 ' ' GLN . . . . . 0.476 ' HA ' ' OE1' ' A' 3591 ' ' GLN . 12.6 mm-40 -72.83 -35.59 67.31 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.576 178.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 63.9 m -61.01 -53.18 60.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.566 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.538 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 11.1 pt-20 -63.17 -38.67 92.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.171 -178.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.1 m -65.88 -46.52 78.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 0.0 110.56 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.558 HD12 ' HB2' ' A' 3599 ' ' PHE . 62.1 tp -62.44 -45.89 91.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.264 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.847 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 62.7 pttt -70.1 -26.87 64.18 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.48 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.55 -39.47 20.35 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.929 0.395 . . . . 0.0 111.305 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.458 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -89.74 -46.07 8.86 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -172.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.558 ' HB2' HD12 ' A' 3595 ' ' LEU . 18.9 m-85 -99.37 -50.35 4.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.667 0.27 . . . . 0.0 111.619 -175.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.847 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.1 mm -62.15 -55.7 22.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 -176.441 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 90.4 m -58.04 -43.68 86.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.001 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.728 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -61.11 -56.93 15.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.895 -0.138 . . . . 0.0 110.782 177.722 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.728 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.7 -43.38 80.46 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -178.671 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -71.58 -38.63 70.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.774 0.321 . . . . 0.0 110.508 -176.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.72 67.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.942 0.401 . . . . 0.0 111.062 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3606 ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' 3602 ' ' TYR . 73.4 mmtt -83.18 -19.56 36.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.737 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3607 ' ' GLN . . . . . 0.589 ' O ' ' HG ' ' A' 3555 ' ' LEU . 77.6 mt-30 54.3 47.46 22.95 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -170.249 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.575 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -127.44 179.0 5.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.791 -171.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.681 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -117.7 118.16 31.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.02 171.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3610 ' ' GLY . . . . . 0.458 ' N ' HD11 ' A' 3603 ' ' LEU . . . -65.45 102.76 0.71 Allowed Glycine 0 C--O 1.221 -0.672 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.493 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.679 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 30.2 mm -88.88 119.89 36.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.229 0.537 . . . . 0.0 110.695 -175.155 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.689 HD13 ' HB3' ' A' 3547 ' ' LEU . 36.3 mt -114.86 106.53 20.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.165 176.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.447 ' HA ' ' O ' ' A' 3624 ' ' TYR . 79.9 m-20 -84.49 129.06 34.89 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.869 176.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' 3537 ' ' SER . 3.3 p . . . . . 0 C--N 1.317 -0.843 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.656 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.447 ' O ' ' HA ' ' A' 3613 ' ' ASN . 72.2 m-85 . . . . . 0 N--CA 1.45 -0.474 0 CA-C-O 120.95 0.405 . . . . 0.0 110.084 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.475 HG13 HG23 ' A' 3611 ' ' ILE . 11.5 t -120.56 113.46 40.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.003 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.665 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -96.3 110.97 23.19 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 170.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.481 ' HB2' ' HB ' ' A' 3660 ' ' VAL . 44.0 mt-30 -94.1 111.9 23.66 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.205 -177.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.595 HG12 HG12 ' A' 3659 ' ' ILE . 37.1 mt -92.05 97.83 7.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.099 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -89.71 135.92 30.06 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.761 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.564 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 37.3 Cg_endo -66.38 171.02 11.1 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.819 2.346 . . . . 0.0 111.698 177.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.27 42.4 0.38 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.129 2.553 . . . . 0.0 113.126 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 24.1 p -75.37 161.78 28.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.425 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -53.18 -35.73 60.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.516 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 24.2 t80 -53.01 -48.73 67.31 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.888 0.375 . . . . 0.0 111.059 176.74 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 10.8 m -67.05 -52.52 41.24 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.39 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -57.17 -43.56 82.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.676 -176.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 23.3 m -65.65 -46.35 79.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.035 0.445 . . . . 0.0 110.613 -177.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 8.0 m80 -63.69 -38.5 91.35 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.696 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 69.3 mt -65.76 -40.83 92.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.809 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.65 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 11.6 p -68.59 -27.09 65.74 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.841 -0.343 . . . . 0.0 110.822 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.3 -47.11 13.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 176.524 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.77 HD13 HD22 ' A' 3575 ' ' LEU . 20.8 mt -77.04 -40.95 44.46 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.394 -173.659 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.482 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -143.09 86.7 9.06 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-O 120.756 0.313 . . . . 0.0 111.216 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.37 -23.07 28.44 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.662 2.241 . . . . 0.0 113.475 -174.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 20.0 t0 -78.37 -49.41 13.61 Favored 'General case' 0 CA--C 1.516 -0.335 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.241 -174.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.781 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -72.3 -30.48 64.83 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.135 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.65 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -55.78 -45.89 78.06 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.131 177.037 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.06 -27.69 68.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.035 0.445 . . . . 0.0 111.206 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 6.9 m -79.28 -39.3 33.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.705 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.681 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.6 pt -80.79 -11.72 12.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 120.903 0.382 . . . . 0.0 111.522 -174.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 45.5 m -57.94 -26.98 62.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.447 175.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -87.06 -34.74 19.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.368 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.681 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.1 tp -104.35 40.19 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-O 122.292 1.044 . . . . 0.0 109.635 -179.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.44 ' N ' ' HD2' ' A' 3655 ' ' PRO . 49.3 m -33.38 -44.66 0.46 Allowed Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 114.113 -1.403 . . . . 0.0 113.829 169.257 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.49 ' HG2' HD12 ' A' 3653 ' ' ILE . 13.5 Cg_endo -59.53 76.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 121.707 1.605 . . . . 0.0 111.819 169.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3656 ' ' HIS . . . . . 0.46 ' HB2' HD23 ' A' 3579 ' ' LEU . 18.5 p80 -146.22 174.06 11.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.781 -176.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.506 HD22 HG22 ' A' 3628 ' ' ILE . 36.5 mt -123.33 144.96 49.11 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.482 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 55.6 ttp -107.17 110.46 22.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.849 HD12 HD21 ' A' 3524 ' ' LEU . 88.9 mt -101.52 115.75 43.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.433 0.635 . . . . 0.0 111.32 -173.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.778 HG13 ' HD2' ' A' 3573 ' ' TYR . 90.8 t -102.75 112.03 34.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.615 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.665 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.7 mt -90.38 112.57 25.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.102 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -112.18 127.46 55.95 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.843 0.354 . . . . 0.0 110.953 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 15.1 p -94.62 109.63 21.53 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 172.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--O 1.249 1.073 0 CA-C-O 117.894 -1.051 . . . . 0.0 111.256 -175.916 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.477 ' CD1' ' HB2' ' A' 3553 ' ' MET . 46.7 m-85 . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.558 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.4 OUTLIER 55.37 -156.65 0.25 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.802 0.81 . . . . 0.0 111.879 174.495 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.434 ' H ' ' HB3' ' B' 2519 ' ' GLU . 4.2 t -153.45 127.01 8.69 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.321 -1.309 . . . . 0.0 107.682 167.58 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.571 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.39 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.524 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.605 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -71.2 -15.71 62.48 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.177 -174.786 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.605 ' N ' HD13 ' A' 3502 ' ' LEU . 52.3 tptt -71.04 -18.31 62.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.494 0.664 . . . . 0.0 109.46 177.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.44 ' HB3' ' CE2' ' A' 3505 ' ' TYR . 29.2 mmtp -104.91 -44.65 4.77 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.92 174.136 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.697 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -151.87 105.6 2.85 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.553 -177.671 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 3506 ' ' PRO . . . . . 0.466 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 88.7 Cg_endo -83.69 173.73 9.19 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.952 3.101 . . . . 0.0 113.655 -175.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.59 HG12 ' CD2' ' A' 3525 ' ' HIS . 61.3 mt -71.56 132.03 33.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.524 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.477 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.3 m -100.38 -31.34 3.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.587 -178.331 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.597 ' HB2' HD13 ' A' 3538 ' ' LEU . 51.4 t-105 -148.59 155.13 40.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 110.521 -177.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -149.02 120.04 7.69 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 176.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -169.58 -127.34 0.92 Allowed Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.649 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.2 mp -141.37 153.91 45.35 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.005 0.431 . . . . 0.0 110.82 178.273 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.485 HD23 ' HB2' ' A' 3547 ' ' LEU . 98.2 mt -107.78 150.83 26.51 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 169.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.746 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -147.83 124.5 11.13 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.779 0.323 . . . . 0.0 111.608 -178.477 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.603 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -136.41 139.58 42.55 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 174.256 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.603 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.0 OUTLIER 62.49 -95.26 0.05 OUTLIER 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 -167.634 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -140.16 6.6 2.16 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.188 176.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.503 ' O ' ' HA ' ' A' 3514 ' ' ALA . 11.9 m-20 -91.22 127.86 36.82 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.366 -174.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.534 HG22 ' HB2' ' A' 3514 ' ' ALA . 40.4 p -119.89 145.3 46.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.936 0.398 . . . . 0.0 111.627 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -142.87 120.16 11.56 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 174.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.645 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.93 118.6 16.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.964 0.412 . . . . 0.0 109.937 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.433 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 33.5 m -126.55 147.59 31.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.725 0.774 . . . . 0.0 112.525 -174.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -106.24 125.31 50.83 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.614 171.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.89 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -96.16 106.43 18.62 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.42 0.629 . . . . 0.0 111.176 -177.875 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.59 ' CD2' HG12 ' A' 3507 ' ' ILE . 29.1 m170 -82.96 138.79 33.67 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.407 176.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.697 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.8 t80 -68.93 137.28 53.68 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 174.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.578 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.3 t -114.66 -56.52 4.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.447 0.641 . . . . 0.0 110.871 177.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.419 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 37.6 m -162.87 171.88 15.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.091 -171.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.61 -155.12 26.59 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.348 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3530 ' ' ASN . . . . . . . . . . . . . 39.2 t30 -100.18 113.82 26.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.619 0.247 . . . . 0.0 110.77 -178.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -64.12 -27.84 69.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.461 -177.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 49.4 t -60.33 -33.09 52.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.865 0.364 . . . . 0.0 110.362 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.476 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 23.0 mt -60.15 -39.76 87.49 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.968 178.041 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.489 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -67.54 -41.36 84.41 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.542 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 32.3 t60 -64.33 -35.0 79.45 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.895 0.379 . . . . 0.0 110.723 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.45 ' HD3' HD23 ' A' 3533 ' ' LEU . 13.3 ptm180 -89.25 -8.99 52.36 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -177.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.449 ' O ' HG21 ' A' 3614 ' ' VAL . 34.0 p -104.87 -39.89 6.13 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.557 177.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.597 HD13 ' HB2' ' A' 3509 ' ' TRP . 26.0 mt -80.69 109.34 12.75 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.039 0.447 . . . . 0.0 109.911 -174.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3539 ' ' PRO . . . . . 0.451 ' HD3' HG21 ' A' 3614 ' ' VAL . 61.1 Cg_endo . . . . . 0 N--CA 1.457 -0.647 0 C-N-CA 122.995 2.464 . . . . 0.0 113.057 -172.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3546 ' ' PRO . . . . . 0.649 ' HA ' ' O ' ' A' 3512 ' ' LEU . 74.0 Cg_endo . . . . . 0 N--CA 1.457 -0.628 0 CA-C-O 121.043 0.351 . . . . 0.0 112.632 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.782 ' HB3' HD13 ' A' 3612 ' ' ILE . 55.3 mt -69.18 120.07 14.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.033 176.587 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.746 ' HA ' ' O ' ' A' 3514 ' ' ALA . 14.3 ptt180 -93.7 141.14 28.82 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.838 0.351 . . . . 0.0 111.285 -176.077 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.666 ' CG2' HD23 ' B' 2521 ' ' LEU . 25.2 mt -99.03 106.19 18.52 Favored 'Isoleucine or valine' 0 C--O 1.245 0.84 0 CA-C-O 121.922 0.867 . . . . 0.0 111.075 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.487 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.03 0.06 14.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.607 -174.638 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.642 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 57.3 mt-30 -148.55 175.31 11.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.514 178.613 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.806 ' HD3' ' HB2' ' B' 2521 ' ' LEU . 0.0 OUTLIER -159.85 140.11 11.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 111.752 -177.182 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.582 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -110.86 120.46 42.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.226 177.145 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3554 ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' 3554 ' ' ARG . 14.8 mmt180 -68.44 109.52 3.73 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.521 ' O ' HD12 ' A' 3555 ' ' LEU . 2.4 pp -71.56 98.3 1.85 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 122.209 1.004 . . . . 0.0 109.623 -177.41 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.518 ' O ' ' HG ' ' A' 3560 ' ' LEU . 36.3 mt-10 -108.87 164.72 12.14 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.026 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.634 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.16 -50.46 66.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.015 0.436 . . . . 0.0 110.214 179.183 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 3.0 p -60.5 -40.76 92.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.617 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.527 ' O ' HG23 ' A' 3563 ' ' VAL . 15.2 mm-40 -63.36 -50.1 71.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.697 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' 3556 ' ' GLU . 85.0 mt -61.13 -31.88 71.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.297 -176.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.634 ' HG2' ' O ' ' A' 3557 ' ' ALA . 18.3 mm-40 -60.74 -50.85 71.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.226 0.536 . . . . 0.0 109.754 174.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3562 ' ' GLY . . . . . 0.409 ' HA2' ' HD2' ' A' 3565 ' ' ARG . . . -63.87 -39.64 97.56 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.168 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.556 ' O ' ' HG3' ' A' 3567 ' ' MET . 90.4 t -60.24 -48.54 87.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.59 0.234 . . . . 0.0 110.782 177.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.66 -30.35 68.68 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.574 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.518 ' HG3' ' O ' ' A' 3561 ' ' GLU . 99.7 mtt180 -57.64 -42.36 83.27 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.528 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3566 ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' 3563 ' ' VAL . 11.5 ptp180 -87.06 -13.59 43.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.949 0.404 . . . . 0.0 110.604 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.556 ' HG3' ' O ' ' A' 3563 ' ' VAL . 85.6 mtp -79.53 -26.54 41.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.988 0.423 . . . . 0.0 110.593 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 15.1 t -85.0 1.37 47.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.188 0.518 . . . . 0.0 110.065 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 40.9 t -116.7 84.32 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.489 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.785 176.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -72.8 108.49 5.79 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3571 ' ' THR . . . . . . . . . . . . . 1.5 m 155.38 -43.52 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 O-C-N 124.998 1.436 . . . . 0.0 108.059 -173.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -86.65 -27.29 23.88 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.968 -177.304 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.771 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -129.41 162.08 28.87 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.939 178.215 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.625 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 48.8 t -124.41 136.91 54.43 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 170.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.791 HD22 HD13 ' A' 3642 ' ' LEU . 14.6 tp -105.85 125.44 50.99 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.634 HD11 HD11 ' A' 3661 ' ' ILE . 82.3 mt -127.11 153.21 46.3 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.111 0.481 . . . . 0.0 110.725 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.644 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.44 107.15 12.54 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.15 -179.538 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.465 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 124.01 38.16 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.416 0.627 . . . . 0.0 110.473 -177.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.476 HD23 ' HB2' ' A' 3656 ' ' HIS . 84.8 mt -125.42 146.31 53.97 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.155 -178.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.32 117.04 3.72 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.195 1.93 . . . . 0.0 111.88 176.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.2 p -107.21 106.7 17.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.286 0.565 . . . . 0.0 110.579 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3582 ' ' GLY . . . . . 0.405 ' H ' HG22 ' A' 3588 ' ' VAL . . . -103.61 147.13 16.62 Favored Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.265 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3583 ' ' ARG . . . . . 0.423 ' HG2' ' CB ' ' A' 3587 ' ' ASP . 35.5 ptt180 -59.01 -35.03 72.56 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.254 0.55 . . . . 0.0 111.115 177.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.573 ' O ' HG23 ' A' 3588 ' ' VAL . 10.3 t70 -142.84 174.19 10.88 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -55.93 -33.86 65.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 118.613 0.642 . . . . 0.0 109.916 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3586 ' ' GLU . . . . . 0.407 ' HG3' ' H ' ' A' 3586 ' ' GLU . 20.1 mt-10 -56.49 -54.68 42.93 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.379 175.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.502 ' O ' ' HG2' ' A' 3591 ' ' GLN . 3.1 t70 -65.84 -36.04 82.35 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.718 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' 3584 ' ' ASP . 99.2 t -57.49 -48.03 83.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.299 178.413 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 65.9 t -60.19 -44.06 94.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.02 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 43.7 t -60.7 -46.59 89.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.153 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3591 ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' 3587 ' ' ASP . 70.9 mm-40 -65.15 -41.48 94.69 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 178.281 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 59.5 m -59.63 -53.28 59.83 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.959 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.39 -36.97 85.89 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.08 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 46.1 m -67.37 -44.52 78.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.883 0.373 . . . . 0.0 110.398 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.554 HD12 ' HB2' ' A' 3599 ' ' PHE . 46.5 tp -65.11 -46.4 81.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.983 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.772 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.93 -31.06 71.77 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.084 -176.989 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.09 -42.26 17.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.674 0.274 . . . . 0.0 111.363 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.4 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -88.16 -45.67 9.92 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -170.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.554 ' HB2' HD12 ' A' 3595 ' ' LEU . 14.3 m-85 -99.48 -50.27 4.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.766 0.317 . . . . 0.0 111.245 -176.293 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.772 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 26.0 mm -61.56 -60.04 3.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.217 -175.584 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 88.8 m -59.08 -32.09 69.47 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 123.185 0.303 . . . . 0.0 111.238 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 42.1 t80 -77.09 -57.04 4.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.569 -177.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' 3608 ' ' ALA . 0.4 OUTLIER -55.97 -38.62 70.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.235 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.39 -32.82 64.68 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.859 -0.337 . . . . 0.0 110.168 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.48 93.54 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.209 0.528 . . . . 0.0 110.689 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -81.38 -16.82 51.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.057 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3607 ' ' GLN . . . . . 0.418 ' O ' ' HG ' ' A' 3555 ' ' LEU . 55.1 mt-30 53.22 49.58 19.59 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -169.478 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.554 ' O ' HD12 ' A' 3603 ' ' LEU . . . -131.12 -178.78 4.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.334 0.588 . . . . 0.0 112.373 -171.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.752 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.81 118.35 30.59 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.572 176.112 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3610 ' ' GLY . . . . . 0.419 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.61 104.84 0.92 Allowed Glycine 0 C--O 1.222 -0.594 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.562 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.642 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 36.4 mm -89.6 121.67 40.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.207 0.527 . . . . 0.0 111.066 -175.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.782 HD13 ' HB3' ' A' 3547 ' ' LEU . 19.3 mt -117.07 113.01 41.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.024 177.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.443 ' HA ' ' O ' ' A' 3624 ' ' TYR . 19.0 m120 -92.09 108.01 19.63 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.445 -179.234 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.451 HG21 ' HD3' ' A' 3539 ' ' PRO . 7.2 p . . . . . 0 C--N 1.316 -0.864 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.635 -171.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.443 ' O ' ' HA ' ' A' 3613 ' ' ASN . 82.7 m-85 . . . . . 0 CA--C 1.513 -0.458 0 CA-C-O 120.891 0.377 . . . . 0.0 110.726 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.423 HG13 HD12 ' A' 3611 ' ' ILE . 4.4 t -118.76 113.92 43.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.287 178.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.624 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.9 mp -97.83 115.53 28.24 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 169.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.56 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 44.0 mt-30 -94.72 111.44 23.22 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.702 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.599 HG12 HG12 ' A' 3659 ' ' ILE . 38.7 mt -90.16 98.59 8.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.254 178.696 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -86.83 139.72 33.05 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.096 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -67.94 172.81 10.19 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.695 2.263 . . . . 0.0 111.52 176.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.21 43.59 0.5 Allowed 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 122.892 2.395 . . . . 0.0 112.58 176.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 24.5 p -74.82 162.84 28.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.767 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -52.25 -40.75 62.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.202 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 31.3 t80 -50.43 -44.65 55.42 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.122 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.5 m -67.54 -56.92 7.58 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.655 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -57.11 -41.42 78.93 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.323 -0.399 . . . . 0.0 112.056 -175.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 12.0 p -66.83 -47.23 72.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.913 0.387 . . . . 0.0 110.869 -177.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 22.4 m-70 -66.9 -36.99 83.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.508 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 77.5 mt -61.89 -35.85 79.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.72 0.295 . . . . 0.0 110.819 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.876 ' HA ' HD22 ' A' 3647 ' ' LEU . 38.2 t -63.4 -37.77 88.58 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.182 0.515 . . . . 0.0 110.491 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3641 ' ' ARG . . . . . 0.594 ' HA ' ' NE ' ' A' 3641 ' ' ARG . 1.7 mmp_? -80.44 -32.23 37.34 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.011 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.791 HD13 HD22 ' A' 3575 ' ' LEU . 32.8 mt -96.63 -27.15 14.94 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -171.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.432 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -159.32 79.69 2.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -178.081 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3644 ' ' PRO . . . . . 0.514 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 3.0 Cg_exo -73.75 -18.75 21.83 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.635 2.224 . . . . 0.0 111.546 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3645 ' ' ASP . . . . . 0.483 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 6.9 m-20 -69.52 -49.91 50.05 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.123 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.644 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -82.71 -25.01 33.35 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.278 179.147 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.876 HD22 ' HA ' ' A' 3640 ' ' SER . 34.8 tp -52.6 -49.69 64.53 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.581 178.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.52 -18.47 59.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.009 0.433 . . . . 0.0 111.632 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 15.5 m -87.33 -38.26 16.39 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.59 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.61 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.0 pt -78.72 -21.76 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -175.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 47.2 m -52.39 -30.31 28.4 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 120.765 0.317 . . . . 0.0 111.326 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -82.96 -42.86 17.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.951 0.405 . . . . 0.0 109.954 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.61 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.6 tp -96.88 39.07 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-O 122.76 1.267 . . . . 0.0 109.168 -178.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.492 ' N ' ' HD2' ' A' 3655 ' ' PRO . 4.3 p -40.41 -37.26 0.84 Allowed Pre-proline 0 CA--C 1.545 0.766 0 CA-C-N 113.449 -1.705 . . . . 0.0 114.961 174.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' 3654 ' ' SER . 22.9 Cg_endo -63.89 74.07 0.17 Allowed 'Trans proline' 0 C--N 1.358 1.038 0 CA-C-N 121.053 1.412 . . . . 0.0 111.529 170.13 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3656 ' ' HIS . . . . . 0.476 ' HB2' HD23 ' A' 3579 ' ' LEU . 18.1 p80 -139.36 173.78 11.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.323 -175.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.473 HD22 HG22 ' A' 3628 ' ' ILE . 32.3 mt -121.69 148.46 44.57 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.33 178.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.3 ttp -111.21 107.89 17.36 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 174.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.89 HD12 HD21 ' A' 3524 ' ' LEU . 74.9 mt -100.91 117.26 45.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.285 0.564 . . . . 0.0 111.524 -171.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.771 HG13 ' HD2' ' A' 3573 ' ' TYR . 56.5 t -101.76 115.93 44.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.147 -178.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.634 HD11 HD11 ' A' 3576 ' ' LEU . 68.0 mt -90.34 113.12 25.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 177.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -108.94 127.34 53.98 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.914 0.388 . . . . 0.0 110.851 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 32.0 t -93.47 136.4 33.78 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.69 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 5.1 m . . . . . 0 C--O 1.246 0.907 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.453 179.739 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.582 ' CD1' ' HB2' ' A' 3553 ' ' MET . 11.8 m-85 . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.634 ' HG2' ' H ' ' B' 2520 ' ' THR . 35.6 tt0 57.85 -163.34 0.2 Allowed 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 174.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.634 ' H ' ' HG2' ' B' 2519 ' ' GLU . 41.3 m -150.56 124.23 9.13 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.283 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.806 ' HB2' ' HD3' ' A' 3552 ' ' ARG . 7.1 tp . . . . . 0 C--N 1.33 -0.276 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.463 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.54 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.0 pp . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.652 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.48 -16.96 64.5 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.677 0.671 . . . . 0.0 110.278 -175.327 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.652 ' N ' HD13 ' A' 3502 ' ' LEU . 56.0 tptt -66.42 -25.8 66.92 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 121.358 0.599 . . . . 0.0 109.385 177.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 61.1 mmtt -105.58 -42.23 5.26 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.992 177.511 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.637 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.19 105.64 3.16 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 121.503 0.668 . . . . 0.0 111.521 -177.657 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -82.86 175.34 8.74 Favored 'Trans proline' 0 CA--C 1.533 0.43 0 C-N-CA 124.24 3.293 . . . . 0.0 113.248 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.487 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 90.9 mt -70.78 132.85 32.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.136 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.565 HG13 ' HB2' ' A' 3526 ' ' PHE . 29.2 m -100.76 -26.39 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.189 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.64 ' HB2' HD13 ' A' 3538 ' ' LEU . 43.2 t-105 -154.89 156.37 36.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.882 0.372 . . . . 0.0 110.779 -178.381 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3510 ' ' GLN . . . . . 0.436 HE21 ' HB3' ' A' 3510 ' ' GLN . 0.9 OUTLIER -151.29 119.22 6.21 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.966 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.74 -131.05 1.29 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.485 -0.646 . . . . 0.0 111.485 -176.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.637 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -140.55 150.38 43.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.217 0.532 . . . . 0.0 111.569 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.46 HD23 ' HB2' ' A' 3547 ' ' LEU . 83.1 mt -105.55 154.02 20.96 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 170.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.718 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -148.72 126.53 11.86 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.491 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.689 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.68 140.62 38.88 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 172.549 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.689 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.4 OUTLIER 62.52 -93.0 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -169.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 8.8 m120 -143.36 11.34 1.71 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 171.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.537 ' HB3' ' HB1' ' A' 3598 ' ' ALA . 27.9 m-20 -88.03 116.98 26.59 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.152 -176.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 21.8 p -110.54 133.42 53.31 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.91 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3520 ' ' ALA . . . . . 1.009 ' HB1' HE22 ' A' 3591 ' ' GLN . . . -135.11 120.1 18.63 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.379 177.005 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.637 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.93 117.76 16.09 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.209 0.528 . . . . 0.0 110.493 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.423 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 28.9 m -127.95 147.48 32.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.725 0.774 . . . . 0.0 112.126 -175.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -105.71 125.81 51.42 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.937 173.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.843 HD21 HD12 ' A' 3659 ' ' ILE . 2.0 mt -97.06 105.96 18.21 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.498 0.666 . . . . 0.0 111.573 -176.665 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.487 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 26.0 m-70 -86.26 138.9 31.5 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.922 -1.035 . . . . 0.0 108.695 176.334 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.637 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.7 t80 -68.57 139.32 55.56 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.556 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.8 t -114.83 -55.67 4.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-O 121.298 0.57 . . . . 0.0 110.994 177.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 58.5 m -163.75 170.76 16.5 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.276 -172.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.87 -150.96 22.66 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.483 174.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.532 ' HB2' ' HA ' ' A' 3571 ' ' THR . 53.8 t-20 -93.45 107.74 19.53 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.342 -0.429 . . . . 0.0 110.553 -175.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -64.06 -30.82 71.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.634 0.254 . . . . 0.0 110.947 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 45.0 t -64.22 -31.57 53.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.955 0.407 . . . . 0.0 110.007 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.513 HD12 ' HB3' ' A' 3530 ' ' ASN . 16.6 mt -59.39 -40.2 85.81 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.774 176.426 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.408 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.87 -39.35 87.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.909 0.385 . . . . 0.0 110.267 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -61.35 -40.18 93.33 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -89.43 -10.13 47.62 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -176.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.652 ' O ' HG11 ' A' 3614 ' ' VAL . 77.5 p -103.87 -37.15 7.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.932 0.396 . . . . 0.0 111.416 -179.018 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.64 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.1 mt -81.85 111.35 25.82 Favored Pre-proline 0 C--N 1.318 -0.783 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo . . . . . 0 N--CA 1.458 -0.584 0 C-N-CA 122.439 2.093 . . . . 0.0 112.985 -174.187 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A 3546 ' ' PRO . . . . . 0.401 ' HA ' ' O ' ' A' 3512 ' ' LEU . 22.0 Cg_endo . . . . . 0 N--CA 1.462 -0.366 0 CA-C-O 121.051 0.355 . . . . 0.0 112.428 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.708 ' HB3' HD13 ' A' 3612 ' ' ILE . 65.4 mt -69.29 109.51 4.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.175 178.16 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.718 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.1 OUTLIER -90.51 134.82 34.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.879 0.371 . . . . 0.0 110.513 -177.784 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.515 HG12 HD11 ' A' 3612 ' ' ILE . 16.9 mt -90.52 107.29 18.3 Favored 'Isoleucine or valine' 0 C--O 1.248 0.997 0 CA-C-O 122.401 1.096 . . . . 0.0 111.061 -177.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.617 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -119.81 10.61 11.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.425 -174.325 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.788 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 32.1 mt-30 -154.49 167.68 29.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.832 -0.167 . . . . 0.0 110.558 179.316 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.41 143.27 14.85 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.869 0.366 . . . . 0.0 111.785 -177.221 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.539 ' O ' ' HA ' ' A' 3608 ' ' ALA . 12.4 tmm? -119.09 134.72 55.03 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.304 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -70.81 109.67 5.13 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.615 ' O ' HD12 ' A' 3555 ' ' LEU . 2.6 pp -74.57 98.23 3.33 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.115 0.96 . . . . 0.0 109.801 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' 3559 ' ' GLN . 19.1 mm-40 -116.36 172.15 7.38 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.296 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.62 68.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.693 0.282 . . . . 0.0 111.268 -176.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 60.1 p -71.11 -37.22 72.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.162 -178.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.492 ' O ' HG23 ' A' 3563 ' ' VAL . 11.7 mm-40 -63.69 -49.51 72.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.536 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3560 ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.09 -35.79 79.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.029 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -66.65 -44.16 82.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.053 0.454 . . . . 0.0 110.586 174.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -52.53 -42.12 57.27 Favored Glycine 0 CA--C 1.518 0.254 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.993 173.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.521 ' O ' ' HG3' ' A' 3567 ' ' MET . 42.7 t -65.82 -49.6 76.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 174.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3564 ' ' ALA . . . . . 0.574 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.08 -27.2 63.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.817 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.545 ' O ' HG22 ' A' 3568 ' ' THR . 0.0 OUTLIER -58.57 -45.57 88.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.88 177.443 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -87.79 -4.44 58.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.074 0.464 . . . . 0.0 110.711 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.574 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 87.6 mtp -85.94 -15.88 40.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.141 178.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3568 ' ' THR . . . . . 0.545 HG22 ' O ' ' A' 3565 ' ' ARG . 11.6 t -85.95 3.13 43.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.11 0.481 . . . . 0.0 110.32 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 20.6 t -117.48 89.61 1.39 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.473 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.14 110.31 3.93 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.532 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.5 m 142.24 -42.97 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.774 1.629 . . . . 0.0 108.279 -177.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.24 -31.16 43.5 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.092 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.691 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -129.85 167.44 18.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.36 -0.382 . . . . 0.0 109.988 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.654 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 49.8 t -128.16 137.15 51.95 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.813 HD22 HD13 ' A' 3642 ' ' LEU . 14.1 tp -106.98 125.97 51.7 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 178.593 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.592 HD11 HD11 ' A' 3661 ' ' ILE . 75.6 mt -127.41 152.42 47.54 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.04 0.448 . . . . 0.0 110.911 -177.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.652 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.35 107.55 13.07 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.52 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.66 119.2 32.93 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.376 0.608 . . . . 0.0 110.339 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.437 ' HG ' HD12 ' A' 3577 ' ' LEU . 48.2 mt -117.19 147.92 41.37 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.251 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3580 ' ' PRO . . . . . 0.457 ' HG2' HD11 ' A' 3653 ' ' ILE . 19.3 Cg_endo -60.45 123.06 12.3 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.234 1.956 . . . . 0.0 111.932 175.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.8 p -117.0 116.53 27.55 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.465 0.65 . . . . 0.0 110.887 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3582 ' ' GLY . . . . . 0.518 ' H ' HG22 ' A' 3588 ' ' VAL . . . -103.66 146.77 16.5 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.948 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -62.78 -36.22 82.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.594 0.711 . . . . 0.0 109.226 178.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.6 ' O ' HG23 ' A' 3588 ' ' VAL . 16.9 t70 -131.23 166.17 21.75 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -55.85 -39.12 70.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.833 0.349 . . . . 0.0 110.648 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -66.42 -42.5 87.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.998 0.427 . . . . 0.0 110.37 177.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.484 ' HB3' ' H ' ' A' 3584 ' ' ASP . 24.1 t70 -61.42 -38.52 87.44 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.152 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' 3584 ' ' ASP . 78.9 t -56.33 -47.41 81.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.44 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 83.0 t -59.42 -47.43 90.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.324 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 36.1 t -60.65 -45.5 93.86 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.162 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3591 ' ' GLN . . . . . 1.009 HE22 ' HB1' ' A' 3520 ' ' ALA . 25.9 tp60 -67.56 -41.58 83.98 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.826 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3592 ' ' THR . . . . . 0.514 ' O ' ' HG3' ' A' 3596 ' ' LYS . 87.7 m -57.6 -52.37 65.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.516 0.198 . . . . 0.0 110.991 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.549 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 12.2 pt-20 -65.13 -31.13 72.16 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.759 0.314 . . . . 0.0 111.32 -178.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 48.9 m -68.71 -48.62 63.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.848 0.356 . . . . 0.0 110.38 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.621 HD12 ' HB2' ' A' 3599 ' ' PHE . 55.9 tp -62.19 -41.89 98.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.843 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.549 ' HE2' ' HA ' ' A' 3593 ' ' GLU . 53.4 mtmt -57.77 -48.16 80.46 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.008 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -75.85 -39.57 56.33 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.537 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -86.97 -46.77 9.54 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -169.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.621 ' HB2' HD12 ' A' 3595 ' ' LEU . 17.4 m-85 -99.51 -50.45 4.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.818 0.342 . . . . 0.0 111.283 -177.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.538 ' HB ' ' O ' ' A' 3596 ' ' LYS . 31.1 mm -61.07 -55.84 21.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.69 -175.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 48.0 m -60.48 -45.94 91.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.248 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.725 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -60.14 -52.28 66.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.724 0.297 . . . . 0.0 110.648 179.193 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.725 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -67.78 -34.1 76.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.785 0.326 . . . . 0.0 110.833 -170.984 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -76.62 -38.89 53.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.139 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.94 -41.12 78.49 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 120.804 0.335 . . . . 0.0 110.936 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -78.32 -10.45 59.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.395 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3607 ' ' GLN . . . . . 0.411 ' O ' ' HG ' ' A' 3555 ' ' LEU . 43.0 mt-30 55.17 47.93 20.64 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.334 0.396 . . . . 0.0 111.017 178.564 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -133.88 171.43 14.19 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -171.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -104.4 117.82 35.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.213 170.211 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -67.78 104.37 1.15 Allowed Glycine 0 C--O 1.222 -0.598 0 C-N-CA 120.636 -0.793 . . . . 0.0 111.702 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.788 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 31.9 mm -90.38 131.24 38.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.073 0.463 . . . . 0.0 111.14 -174.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.708 HD13 ' HB3' ' A' 3547 ' ' LEU . 55.3 mt -131.46 108.83 15.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.039 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.688 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.0 m120 -81.06 136.47 35.96 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.25 0.547 . . . . 0.0 111.033 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.652 HG11 ' O ' ' A' 3537 ' ' SER . 21.3 t . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.807 -177.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.688 ' O ' ' HA ' ' A' 3613 ' ' ASN . 62.0 m-85 . . . . . 0 CA--C 1.509 -0.621 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.459 HG13 HG23 ' A' 3611 ' ' ILE . 3.8 t -125.2 113.71 36.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.003 177.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.636 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -96.74 112.19 24.05 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 169.576 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3627 ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -94.51 110.57 22.36 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -178.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.594 HG12 HG12 ' A' 3659 ' ' ILE . 32.9 mt -90.98 99.26 9.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.993 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3629 ' ' PHE . . . . . 0.444 ' CE1' ' HB2' ' A' 3609 ' ' ALA . 78.3 m-85 -89.83 138.44 27.88 Favored Pre-proline 0 C--N 1.318 -0.778 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.12 178.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.597 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 36.4 Cg_endo -65.53 169.57 12.49 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.556 2.171 . . . . 0.0 111.113 175.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.0 53.45 1.53 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 122.703 2.269 . . . . 0.0 112.51 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 26.0 p -81.03 162.63 23.71 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.429 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -52.2 -41.06 62.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.542 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 26.4 t80 -57.46 -44.73 85.03 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 14.6 m -61.58 -58.47 7.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.77 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -60.16 -37.87 81.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.465 -174.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 39.6 m -66.81 -49.97 64.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.838 0.352 . . . . 0.0 110.74 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -65.38 -32.63 74.37 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.554 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 50.8 mt -63.5 -35.19 79.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.365 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.661 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 19.3 t -72.04 -33.33 67.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.049 0.452 . . . . 0.0 110.148 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -78.97 -30.65 44.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.02 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.813 HD13 HD22 ' A' 3575 ' ' LEU . 22.4 mt -93.49 -38.84 11.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.893 -177.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -144.64 74.93 14.94 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -176.743 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3644 ' ' PRO . . . . . 0.44 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 36.5 Cg_endo -66.58 -17.8 53.38 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 122.485 2.123 . . . . 0.0 112.324 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3645 ' ' ASP . . . . . 0.598 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.3 m-20 -72.66 -50.01 27.89 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.338 -177.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.652 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -82.56 -27.04 31.85 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 178.38 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.661 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -53.49 -42.99 67.85 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.156 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -65.18 -17.97 64.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.635 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 15.0 m -89.75 -34.19 16.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.923 0.392 . . . . 0.0 110.72 177.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.717 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.4 pt -85.52 -13.37 11.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -174.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 12.0 p -56.72 -31.31 64.4 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.192 0.52 . . . . 0.0 110.464 175.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 9.4 t30 -83.31 -36.74 24.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.673 174.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.717 HG22 ' HA ' ' A' 3650 ' ' ILE . 20.8 tt -104.59 45.17 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 122.741 1.258 . . . . 0.0 110.103 -177.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.471 ' N ' ' HD2' ' A' 3655 ' ' PRO . 19.9 m -33.7 -42.0 0.36 Allowed Pre-proline 0 CA--C 1.541 0.624 0 CA-C-N 113.403 -1.726 . . . . 0.0 113.845 166.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.517 ' HD2' ' C ' ' A' 3653 ' ' ILE . 23.6 Cg_endo -65.02 84.16 0.18 Allowed 'Trans proline' 0 C--N 1.359 1.123 0 CA-C-N 120.532 1.226 . . . . 0.0 111.715 173.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 28.6 p80 -152.15 173.35 15.06 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.137 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.423 HD22 HG22 ' A' 3628 ' ' ILE . 35.4 mt -121.98 142.27 50.49 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.165 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.6 ttp -105.16 111.23 23.9 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 176.039 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.843 HD12 HD21 ' A' 3524 ' ' LEU . 85.5 mt -103.61 119.59 52.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.264 0.554 . . . . 0.0 111.381 -172.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.691 HG13 ' HD2' ' A' 3573 ' ' TYR . 87.1 t -106.35 113.31 42.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.859 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.654 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 46.8 mt -91.02 113.7 27.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.082 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.58 129.22 56.14 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.71 0.291 . . . . 0.0 111.503 -178.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 4.7 m -71.65 116.54 12.14 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 172.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 45.7 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.527 -0.749 . . . . 0.0 110.567 -177.578 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.525 ' CD1' ' HB2' ' A' 3553 ' ' MET . 22.9 m-85 . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 120.48 0.181 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.912 ' HG3' ' H ' ' B' 2520 ' ' THR . 2.4 tp10 57.69 -159.19 0.26 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.884 0.373 . . . . 0.0 110.281 175.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.912 ' H ' ' HG3' ' B' 2519 ' ' GLU . 89.5 m -150.75 133.7 15.95 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 171.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.617 ' H ' ' C ' ' A' 3550 ' ' ALA . 35.7 tp . . . . . 0 CA--C 1.516 -0.354 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.301 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.576 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp . . . . . 0 N--CA 1.457 -0.092 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.633 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -68.12 -16.38 63.98 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.417 -172.307 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.633 ' N ' HD13 ' A' 3502 ' ' LEU . 0.7 OUTLIER -78.2 -21.03 50.67 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.18 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -98.7 -43.0 6.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.356 0.598 . . . . 0.0 109.74 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.709 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -147.51 100.15 3.81 Favored Pre-proline 0 N--CA 1.444 -0.739 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.773 179.934 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -82.71 173.89 10.03 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 123.985 3.123 . . . . 0.0 113.693 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.575 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 90.3 mt -71.23 133.73 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.047 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.463 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.0 m -101.95 -30.0 3.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.481 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.778 ' HE3' HD12 ' A' 3524 ' ' LEU . 26.1 t90 -147.04 154.64 41.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.652 0.263 . . . . 0.0 110.373 -174.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -150.59 121.55 7.66 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -175.78 -129.33 1.2 Allowed Glycine 0 N--CA 1.441 -0.976 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -178.368 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.644 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -140.13 152.18 45.9 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.076 0.465 . . . . 0.0 111.07 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.473 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.0 mt -105.69 149.72 26.12 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 168.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.55 125.97 14.02 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -177.192 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.644 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.86 144.89 41.63 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 172.932 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.644 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.3 OUTLIER 62.63 -90.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.051 0.54 . . . . 0.0 110.337 -169.989 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -148.65 12.97 0.91 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.45 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.41 ' O ' ' HA ' ' A' 3514 ' ' ALA . 20.8 m-20 -106.01 144.06 33.26 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.76 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.514 HG22 ' HB2' ' A' 3514 ' ' ALA . 20.0 p -125.94 143.6 51.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.473 -177.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.67 115.06 13.36 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.256 174.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.644 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.44 116.34 12.77 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.956 0.407 . . . . 0.0 109.913 179.007 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.422 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -128.57 148.0 33.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 121.607 0.718 . . . . 0.0 111.75 -175.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -109.26 125.36 52.19 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.854 173.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.842 HD21 HD12 ' A' 3659 ' ' ILE . 1.0 OUTLIER -94.51 112.42 24.19 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.39 0.614 . . . . 0.0 111.86 -174.784 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.575 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 62.9 m-70 -88.15 138.53 31.36 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.799 176.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.709 ' O ' ' HB2' ' A' 3505 ' ' TYR . 66.2 t80 -67.28 138.18 56.66 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 174.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.559 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.3 t -114.99 -58.38 3.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.177 0.513 . . . . 0.0 110.971 177.484 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.508 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 58.3 m -160.2 171.4 19.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.537 -171.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.61 -148.96 20.26 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.125 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.552 ' HB2' ' HA ' ' A' 3571 ' ' THR . 44.0 t-20 -108.23 118.53 37.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.945 0.402 . . . . 0.0 110.117 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.8 p30 -63.34 -28.21 69.85 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.907 -174.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 57.5 t -60.88 -33.47 55.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.752 0.311 . . . . 0.0 110.722 -177.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.536 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 19.7 mt -57.65 -42.68 83.97 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.076 177.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.401 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -68.38 -38.44 81.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.881 0.372 . . . . 0.0 110.907 -178.146 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 29.8 t60 -66.17 -36.48 83.22 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.612 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -89.73 -6.29 56.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3537 ' ' SER . . . . . . . . . . . . . 20.5 p -104.04 -43.34 5.3 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 122.005 -0.434 . . . . 0.0 111.271 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.662 HD13 ' HB2' ' A' 3509 ' ' TRP . 22.4 mt -79.36 110.81 16.5 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.982 0.42 . . . . 0.0 110.196 -173.591 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3539 ' ' PRO . . . . . 0.508 ' HD3' HG21 ' A' 3614 ' ' VAL . 36.6 Cg_endo . . . . . 0 N--CA 1.462 -0.336 0 C-N-CA 122.965 2.443 . . . . 0.0 112.87 -174.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3546 ' ' PRO . . . . . 0.622 ' HA ' ' O ' ' A' 3512 ' ' LEU . 29.0 Cg_endo . . . . . 0 C--O 1.236 0.403 0 N-CA-C 113.211 0.427 . . . . 0.0 113.211 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.733 ' HB3' HD13 ' A' 3612 ' ' ILE . 39.1 mt -69.27 118.64 12.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.834 174.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -99.22 139.23 35.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 111.643 -174.342 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.407 ' CG2' HD13 ' B' 2521 ' ' LEU . 25.9 mt -95.6 107.83 20.16 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 121.603 0.716 . . . . 0.0 111.609 -175.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.496 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -118.08 1.98 12.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.002 -175.59 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.667 ' HA ' ' HA ' ' B' 2520 ' ' THR . 62.4 mt-30 -145.64 171.43 14.73 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.527 -0.175 . . . . 0.0 110.527 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.792 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.2 138.89 11.66 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 120.73 0.3 . . . . 0.0 111.172 -179.691 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.572 ' HG3' ' CE1' ' B' 2518 ' ' TYR . 10.8 tmm? -109.67 132.27 54.3 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.116 -0.233 . . . . 0.0 110.885 -178.11 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3554 ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' 3554 ' ' ARG . 0.1 OUTLIER -63.71 109.03 1.57 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.181 -179.426 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.554 ' HB2' HD21 ' A' 3560 ' ' LEU . 3.5 pp -81.95 97.27 8.0 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 122.754 1.264 . . . . 0.0 109.411 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.56 ' H ' ' HB2' ' A' 3559 ' ' GLN . 13.9 mm-40 -111.4 166.49 11.08 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.741 -1.572 . . . . 0.0 108.855 177.661 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.503 ' O ' ' HG3' ' A' 3561 ' ' GLU . . . -54.02 -52.39 60.97 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.973 0.416 . . . . 0.0 111.038 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 25.5 p -65.6 -40.1 92.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.138 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.56 ' HB2' ' H ' ' A' 3556 ' ' GLU . 15.9 mm100 -65.03 -40.45 94.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.276 -179.089 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' 3555 ' ' LEU . 98.5 mt -62.85 -37.94 88.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.772 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' 3557 ' ' ALA . 12.8 mt-10 -68.65 -33.22 73.63 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 175.78 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3562 ' ' GLY . . . . . 0.481 ' O ' ' HB3' ' A' 3565 ' ' ARG . . . -64.75 -33.52 87.44 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.647 173.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.564 ' O ' ' HG2' ' A' 3566 ' ' ARG . 56.4 t -70.69 -45.75 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 174.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3564 ' ' ALA . . . . . 0.549 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.54 -27.03 64.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.122 178.736 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.481 ' HB3' ' O ' ' A' 3562 ' ' GLY . 75.5 ttt180 -55.3 -45.02 76.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.178 177.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3566 ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' 3563 ' ' VAL . 9.2 ptp180 -87.2 -14.7 40.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.961 0.41 . . . . 0.0 110.844 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.549 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 78.0 mtp -83.3 -20.1 35.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.537 -176.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 11.2 t -88.1 4.04 46.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.959 0.409 . . . . 0.0 110.842 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 46.4 t -127.39 102.65 9.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-O 121.05 0.452 . . . . 0.0 110.748 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3570 ' ' GLU . . . . . 0.571 ' O ' ' HB ' ' A' 3571 ' ' THR . 1.7 mp0 -62.01 139.8 58.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.074 177.331 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.571 ' HB ' ' O ' ' A' 3570 ' ' GLU . 73.4 m 95.1 -27.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 O-C-N 124.199 0.937 . . . . 0.0 110.069 179.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.01 -31.57 50.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.72 171.326 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.731 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -138.28 167.17 22.42 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.048 177.708 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.643 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 29.4 t -129.11 135.99 49.62 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 171.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.759 HD22 HD13 ' A' 3642 ' ' LEU . 13.9 tp -106.58 126.31 52.11 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.614 HD11 HD11 ' A' 3661 ' ' ILE . 82.4 mt -128.17 151.79 48.82 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.596 -178.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.628 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -118.76 109.11 15.68 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.915 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.549 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.08 119.05 32.39 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.406 0.622 . . . . 0.0 110.469 -177.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.451 ' HG ' HD12 ' A' 3577 ' ' LEU . 82.9 mt -121.57 142.31 35.42 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.73 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.48 134.94 61.47 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.234 1.956 . . . . 0.0 111.359 177.077 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.2 p -124.52 114.53 19.55 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.142 0.496 . . . . 0.0 110.461 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3582 ' ' GLY . . . . . 0.404 ' HA2' ' OD2' ' A' 3587 ' ' ASP . . . -104.23 146.33 16.25 Favored Glycine 0 N--CA 1.443 -0.851 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.588 -178.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 13.1 mtm-85 -62.55 -48.87 77.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.757 0.789 . . . . 0.0 109.359 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.589 ' O ' HG23 ' A' 3588 ' ' VAL . 5.0 m-20 -125.87 174.95 8.01 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.177 -176.158 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -53.48 -48.4 68.95 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.347 0.404 . . . . 0.0 110.886 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -64.76 -38.96 92.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.58 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.446 ' HB3' ' H ' ' A' 3584 ' ' ASP . 27.8 t70 -65.15 -41.91 94.28 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.218 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' 3584 ' ' ASP . 79.2 t -57.25 -43.61 82.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.501 176.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 11.7 t -62.49 -50.91 77.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.481 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 6.0 m -55.83 -48.58 75.2 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.363 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -64.28 -41.71 96.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.577 0.227 . . . . 0.0 110.848 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3592 ' ' THR . . . . . 0.445 ' O ' ' HG3' ' A' 3596 ' ' LYS . 28.8 m -62.06 -43.84 97.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.033 0.444 . . . . 0.0 109.876 176.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -59.67 -51.08 71.32 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.98 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 32.4 m -59.37 -44.97 92.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.686 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.5 HD12 ' HB2' ' A' 3599 ' ' PHE . 48.0 tp -62.38 -43.34 99.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.917 -178.1 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.516 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 55.4 mtmt -59.68 -51.73 68.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.624 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -69.77 -33.63 72.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.291 -175.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -95.45 -46.78 6.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -171.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.5 ' HB2' HD12 ' A' 3595 ' ' LEU . 27.3 m-85 -100.3 -51.03 3.75 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 -174.656 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.516 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.9 mm -62.38 -60.54 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.359 -173.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 88.0 m -58.0 -39.71 78.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.394 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.438 ' HE1' HD11 ' B' 2521 ' ' LEU . 45.6 t80 -71.74 -56.15 6.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.529 -176.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' 3608 ' ' ALA . 0.3 OUTLIER -56.24 -39.81 73.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.726 -0.216 . . . . 0.0 111.329 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -75.88 -30.52 58.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.766 0.317 . . . . 0.0 110.297 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -65.79 -38.69 89.7 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.408 0.623 . . . . 0.0 110.248 176.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -79.5 -18.9 50.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.953 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3607 ' ' GLN . . . . . 0.443 ' O ' ' HG ' ' A' 3555 ' ' LEU . 52.5 mt-30 51.26 51.11 17.6 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -170.028 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.553 ' O ' HD12 ' A' 3603 ' ' LEU . . . -133.23 -177.68 4.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.739 -174.249 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.792 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -117.7 118.33 31.8 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.131 176.103 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3610 ' ' GLY . . . . . 0.511 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.2 104.18 0.85 Allowed Glycine 0 C--O 1.223 -0.548 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.492 178.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.666 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 37.3 mm -90.0 123.36 42.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.188 0.518 . . . . 0.0 110.95 -175.714 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.733 HD13 ' HB3' ' A' 3547 ' ' LEU . 40.6 mt -118.52 105.96 18.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.83 175.318 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.465 ' HA ' ' O ' ' A' 3624 ' ' TYR . 11.7 m120 -84.74 109.33 17.97 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.233 178.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.508 HG21 ' HD3' ' A' 3539 ' ' PRO . 10.7 p . . . . . 0 C--N 1.314 -0.975 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.982 -172.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.465 ' O ' ' HA ' ' A' 3613 ' ' ASN . 70.7 m-85 . . . . . 0 N--CA 1.452 -0.367 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.443 HG13 HD12 ' A' 3611 ' ' ILE . 4.1 t -117.14 115.64 49.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.166 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.635 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -99.31 112.96 25.02 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 170.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.429 ' O ' ' HA ' ' A' 3659 ' ' ILE . 13.5 mt-30 -94.16 111.06 22.76 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.664 -177.022 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.608 HG12 HG12 ' A' 3659 ' ' ILE . 47.3 mt -93.97 99.46 9.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.548 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -91.17 138.49 25.79 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.451 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.34 168.32 22.65 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.786 2.324 . . . . 0.0 111.677 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -64.81 81.52 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.805 2.337 . . . . 0.0 112.243 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 7.9 p -111.84 162.08 15.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.017 -176.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3633 ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' 3633 ' ' GLU . 1.7 mp0 -54.72 -37.84 66.35 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.151 -179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3634 ' ' PHE . . . . . 0.433 ' CE2' ' HB3' ' A' 3560 ' ' LEU . 31.9 t80 -65.87 -42.78 89.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.097 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 67.1 p -62.86 -54.08 44.27 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.968 -178.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3636 ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' 3633 ' ' GLU . 0.6 OUTLIER -59.55 -38.14 80.29 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.643 0.258 . . . . 0.0 111.375 -179.364 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 48.1 t -56.71 -53.19 60.63 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.816 178.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -74.3 -30.57 62.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.949 -178.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3639 ' ' LEU . . . . . 0.472 ' HB3' HD23 ' A' 3647 ' ' LEU . 49.2 mt -62.53 -39.64 94.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.444 0.164 . . . . 0.0 110.891 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.537 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 24.3 m -63.97 -39.66 94.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.198 0.523 . . . . 0.0 110.54 177.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -72.07 -43.4 64.94 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.675 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.759 HD13 HD22 ' A' 3575 ' ' LEU . 20.0 mt -83.5 -42.03 17.33 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.442 -173.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.437 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -142.63 83.5 11.7 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.828 0.347 . . . . 0.0 111.438 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.73 -26.03 28.14 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.666 2.244 . . . . 0.0 113.307 -175.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 5.6 t0 -71.84 -47.83 50.38 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -173.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.628 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.03 -29.37 49.35 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.359 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.537 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.14 -51.58 63.81 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.892 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.03 -25.4 66.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.933 0.397 . . . . 0.0 111.136 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 17.6 m -79.36 -36.35 39.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.029 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.573 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.4 pt -81.42 -10.44 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.237 0 CA-C-O 120.755 0.312 . . . . 0.0 111.349 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 9.4 t -59.08 -26.53 64.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.142 0.496 . . . . 0.0 109.701 174.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 13.9 m120 -79.68 -41.21 27.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.326 0.584 . . . . 0.0 110.111 175.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.573 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.6 tp -105.29 40.32 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 122.22 1.01 . . . . 0.0 109.821 -177.343 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.5 ' N ' ' HD2' ' A' 3655 ' ' PRO . 50.8 m -40.43 -40.61 2.08 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-N 114.521 -1.218 . . . . 0.0 113.6 173.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' 3654 ' ' SER . 14.9 Cg_endo -60.24 78.57 0.07 OUTLIER 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 121.568 1.512 . . . . 0.0 111.864 169.065 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3656 ' ' HIS . . . . . 0.43 ' CB ' HD23 ' A' 3579 ' ' LEU . 32.6 p80 -150.46 -178.64 6.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.636 -179.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.482 ' HB3' HG23 ' A' 3628 ' ' ILE . 24.0 mt -124.74 142.59 51.3 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.71 -178.482 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 61.2 ttp -102.69 110.99 23.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.842 HD12 HD21 ' A' 3524 ' ' LEU . 84.0 mt -103.88 121.29 55.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-O 121.306 0.574 . . . . 0.0 111.492 -173.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.731 HG13 ' HD2' ' A' 3573 ' ' TYR . 85.1 t -107.27 116.4 50.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.661 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.643 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 64.3 mt -90.81 112.19 24.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 177.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -108.52 128.52 54.88 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.881 0.372 . . . . 0.0 111.322 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 9.2 m -68.95 114.63 7.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.005 174.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 63.2 t . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.914 -0.565 . . . . 0.0 110.155 179.196 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.572 ' CE1' ' HG3' ' A' 3553 ' ' MET . 8.0 m-85 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 111.172 0.064 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.596 ' HG2' ' H ' ' B' 2520 ' ' THR . 15.7 tt0 57.01 -158.74 0.26 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 177.437 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.667 ' HA ' ' HA ' ' A' 3551 ' ' GLN . 8.0 t -157.44 124.55 5.13 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 172.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.664 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.611 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.3 pp . . . . . 0 CA--C 1.528 0.111 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.666 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -71.82 -13.65 61.75 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.429 -173.301 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.543 ' N ' HD13 ' A' 3502 ' ' LEU . 51.4 tptt -67.64 -23.7 65.37 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 174.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 36.0 mmtm -103.27 -42.66 5.67 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.261 176.614 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.684 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -146.87 103.08 3.88 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-O 121.471 0.653 . . . . 0.0 110.796 179.252 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 3506 ' ' PRO . . . . . 0.666 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 94.0 Cg_endo -82.11 174.39 10.1 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 123.972 3.115 . . . . 0.0 113.556 -176.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.518 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 82.1 mt -71.22 133.12 32.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.536 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.475 HG13 ' HB2' ' A' 3526 ' ' PHE . 33.8 m -101.89 -24.55 4.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.364 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.638 ' HB2' HD13 ' A' 3538 ' ' LEU . 50.4 t-105 -156.13 154.73 31.34 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.805 0.336 . . . . 0.0 110.786 -176.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -147.57 120.08 8.5 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -171.1 -132.92 1.54 Allowed Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.723 -177.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.574 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -139.83 149.0 42.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.182 0.515 . . . . 0.0 111.546 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.486 HD23 ' HB2' ' A' 3547 ' ' LEU . 93.8 mt -105.1 144.38 31.97 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 170.161 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.696 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -141.98 124.44 15.74 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.738 0.304 . . . . 0.0 111.61 -177.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.67 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.31 146.37 44.54 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 173.903 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.67 ' CD ' HD12 ' A' 3515 ' ' LEU . 1.2 mptm? 62.64 -93.69 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -167.066 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 22.4 m120 -147.26 11.95 1.04 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.343 175.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' 3514 ' ' ALA . 3.9 t0 -100.09 138.72 36.78 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.129 -175.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.615 HG22 ' HB2' ' A' 3514 ' ' ALA . 28.0 p -123.58 127.69 48.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.087 0.47 . . . . 0.0 111.88 -175.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -120.71 115.64 23.72 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.395 175.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.574 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.75 120.78 18.85 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.429 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -130.38 147.93 33.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.538 0.685 . . . . 0.0 111.834 -175.255 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -111.1 126.09 54.46 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.986 173.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.938 HD21 HD12 ' A' 3659 ' ' ILE . 0.8 OUTLIER -95.51 112.63 24.31 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.34 0.59 . . . . 0.0 111.986 -173.999 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.518 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 74.9 m-70 -85.53 140.28 30.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.757 174.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.684 ' O ' ' HB2' ' A' 3505 ' ' TYR . 58.9 t80 -70.17 136.64 50.28 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 175.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.598 ' CG1' HD23 ' A' 3575 ' ' LEU . 19.6 t -115.36 -51.96 4.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.081 0.467 . . . . 0.0 111.372 178.04 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 25.8 t -162.19 170.39 19.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.706 -170.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.25 -149.21 21.19 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.854 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.544 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.5 t-20 -104.7 117.02 33.05 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.773 0.32 . . . . 0.0 110.713 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 12.2 p30 -61.15 -36.28 79.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3532 ' ' VAL . . . . . 0.446 HG12 ' HD2' ' A' 3536 ' ' ARG . 57.8 t -59.95 -33.41 52.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.559 0.218 . . . . 0.0 110.489 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.54 HD23 ' HD3' ' A' 3536 ' ' ARG . 16.4 mt -56.7 -40.99 76.6 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.235 178.054 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.453 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.81 -47.26 72.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.885 0.374 . . . . 0.0 110.378 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -59.89 -35.59 75.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.946 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.54 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.4 ptm180 -88.95 -11.09 45.37 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.02 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.523 ' O ' HG21 ' A' 3614 ' ' VAL . 57.5 p -103.05 -37.52 7.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.976 0.417 . . . . 0.0 111.227 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.638 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.3 mt -78.88 112.01 24.14 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -174.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo . . . . . 0 N--CA 1.461 -0.403 0 C-N-CA 123.255 2.636 . . . . 0.0 113.989 -166.718 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo . . . . . 0 N--CA 1.463 -0.278 0 CA-C-O 120.996 0.332 . . . . 0.0 112.614 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.707 ' HB3' HD13 ' A' 3612 ' ' ILE . 57.0 mt -78.0 118.05 19.91 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.264 177.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.696 ' HA ' ' O ' ' A' 3514 ' ' ALA . 23.8 ptt180 -103.52 141.62 35.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.074 0.464 . . . . 0.0 111.401 -177.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.481 HD12 HD22 ' A' 3515 ' ' LEU . 19.5 mt -94.12 107.23 19.04 Favored 'Isoleucine or valine' 0 C--O 1.254 1.326 0 CA-C-O 122.705 1.24 . . . . 0.0 111.648 -172.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.468 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -108.94 -6.52 15.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.891 -173.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.686 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 52.6 mt-30 -148.29 176.95 9.83 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.363 0.125 . . . . 0.0 111.142 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -155.83 136.79 13.62 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.884 0.374 . . . . 0.0 111.585 -178.945 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.603 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 14.1 tmm? -110.39 121.67 45.85 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.398 177.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -71.78 110.64 6.45 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.549 ' HB2' HD21 ' A' 3560 ' ' LEU . 2.9 pp -71.98 98.65 2.09 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 122.278 1.037 . . . . 0.0 110.054 -176.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.612 ' O ' ' HG ' ' A' 3560 ' ' LEU . 43.4 mt-10 -113.09 166.42 11.45 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.309 176.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -53.24 -47.48 68.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.063 0.459 . . . . 0.0 111.11 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 1.6 p -63.04 -38.39 91.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.507 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.551 ' O ' HG23 ' A' 3563 ' ' VAL . 20.0 mm-40 -74.27 -37.59 63.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.168 -177.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' 3556 ' ' GLU . 86.0 mt -61.72 -35.32 77.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.729 0.3 . . . . 0.0 110.488 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -62.85 -46.17 89.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.961 173.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -62.32 -34.07 88.1 Favored Glycine 0 CA--C 1.519 0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.499 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.565 ' O ' ' HG3' ' A' 3567 ' ' MET . 59.2 t -66.87 -49.5 73.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.287 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3564 ' ' ALA . . . . . 0.566 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.74 -27.54 68.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.063 178.298 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -54.76 -47.34 74.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.533 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.2 ptp85 -85.17 -14.41 47.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.078 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.566 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 87.6 mtp -83.08 -19.58 36.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.804 0.335 . . . . 0.0 111.153 -179.047 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3568 ' ' THR . . . . . 0.43 HG23 ' O ' ' A' 3564 ' ' ALA . 37.0 p -80.36 -21.45 42.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.144 0.497 . . . . 0.0 110.549 177.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 23.3 t -106.19 78.65 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.572 177.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.66 108.21 1.99 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.665 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.544 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.7 m 155.96 -45.85 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.373 1.469 . . . . 0.0 107.732 -173.171 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -86.76 -14.86 41.11 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.295 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.656 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -134.81 162.88 31.12 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.758 175.475 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.622 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 34.2 t -128.23 133.94 48.92 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.312 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.783 HD22 HD13 ' A' 3642 ' ' LEU . 12.6 tp -105.61 125.41 50.96 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.588 HD11 HD11 ' A' 3661 ' ' ILE . 81.4 mt -125.78 154.52 42.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.85 -177.024 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.722 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.72 108.14 13.62 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.186 179.76 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.451 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.28 123.64 37.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.236 0.541 . . . . 0.0 110.591 -178.08 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.414 HD23 ' HB2' ' A' 3656 ' ' HIS . 73.7 mt -124.63 143.71 44.22 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.258 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.47 117.96 4.78 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.46 2.107 . . . . 0.0 112.21 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.7 p -110.08 119.62 39.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.127 0.489 . . . . 0.0 110.029 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -102.82 145.19 16.27 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.735 -177.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 44.3 mtm180 -70.52 -25.18 63.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.782 0.801 . . . . 0.0 109.87 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.576 ' O ' HG23 ' A' 3588 ' ' VAL . 23.9 t70 -147.9 169.95 18.72 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.354 -1.294 . . . . 0.0 108.257 -175.673 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.53 -49.59 67.3 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.042 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -60.93 -37.96 84.14 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.688 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.556 ' HB3' ' H ' ' A' 3584 ' ' ASP . 6.4 t70 -66.97 -40.83 87.53 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.548 -177.508 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' 3584 ' ' ASP . 94.1 t -58.68 -39.49 76.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.178 0.514 . . . . 0.0 110.385 178.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 3.0 t -63.49 -48.27 87.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.457 177.547 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 71.9 m -58.72 -47.31 85.02 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 114.178 -1.374 . . . . 0.0 111.703 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3591 ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' 3587 ' ' ASP . 71.6 mm-40 -63.87 -45.08 91.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.478 0.18 . . . . 0.0 110.758 -179.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 46.3 m -57.59 -47.4 82.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.16 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.42 ' HA ' ' HE3' ' A' 3596 ' ' LYS . 9.5 tp10 -60.91 -50.7 72.37 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.887 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 19.4 m -60.65 -45.25 94.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.187 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.529 HD12 ' HB2' ' A' 3599 ' ' PHE . 44.8 tp -64.08 -45.93 86.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.568 -175.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.785 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -71.29 -25.55 62.49 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.061 -176.164 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.55 -40.56 18.96 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.403 178.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.493 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -92.36 -45.97 7.92 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -171.105 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.529 ' HB2' HD12 ' A' 3595 ' ' LEU . 21.1 m-85 -98.47 -50.17 4.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.256 -174.438 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.785 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 21.8 mm -61.46 -58.09 9.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.738 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 98.0 m -55.57 -41.06 72.77 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 123.352 0.407 . . . . 0.0 111.456 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.749 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -68.48 -56.98 6.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.614 -0.267 . . . . 0.0 111.333 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.749 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.52 -43.55 79.89 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.526 0.203 . . . . 0.0 111.521 -177.182 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -68.07 -37.29 81.1 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.496 -177.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.25 -37.3 77.88 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.038 0.447 . . . . 0.0 110.822 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -77.35 -18.6 57.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.824 179.064 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 50.03 53.03 13.54 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -169.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.52 ' O ' HD12 ' A' 3603 ' ' LEU . . . -135.69 -176.02 4.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.312 -171.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.05 118.26 30.15 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.499 176.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3610 ' ' GLY . . . . . 0.424 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.93 103.78 0.84 Allowed Glycine 0 C--O 1.222 -0.605 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.485 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.686 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 31.0 mm -88.99 120.37 37.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.175 0.512 . . . . 0.0 111.055 -174.102 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.707 HD13 ' HB3' ' A' 3547 ' ' LEU . 35.0 mt -119.24 117.83 55.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.879 176.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.542 ' HA ' ' O ' ' A' 3624 ' ' TYR . 30.5 m-80 -96.73 126.04 41.62 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.348 -178.083 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.646 HG22 ' HB2' ' A' 3624 ' ' TYR . 3.4 m . . . . . 0 C--N 1.32 -0.691 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 176.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.646 ' HB2' HG22 ' A' 3614 ' ' VAL . 19.5 m-85 . . . . . 0 CA--C 1.513 -0.451 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 10.7 t -117.76 114.12 44.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.555 177.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.62 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -99.36 111.19 23.6 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 169.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.547 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 40.5 mt-30 -93.85 111.76 23.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.928 -178.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.596 HG12 HG12 ' A' 3659 ' ' ILE . 42.1 mt -89.14 98.05 7.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.166 178.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -87.48 141.94 32.69 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.86 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.514 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 53.4 Cg_endo -69.3 172.96 11.27 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 122.656 2.237 . . . . 0.0 111.513 176.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.88 40.36 0.42 Allowed 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.801 2.334 . . . . 0.0 112.571 176.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 22.6 p -72.05 161.63 30.62 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.852 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -51.2 -39.58 56.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.003 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 33.9 t80 -50.76 -53.88 28.03 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.04 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 5.6 m -62.72 -56.81 14.24 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.92 -177.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.45 -41.81 69.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.881 -175.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 21.3 m -67.46 -47.89 68.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.128 -176.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 57.4 m80 -64.24 -35.77 81.9 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.271 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.22 -34.16 77.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.962 176.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.677 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 37.7 m -67.02 -29.63 69.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.76 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.59 -56.45 3.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.166 176.309 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.783 HD13 HD22 ' A' 3575 ' ' LEU . 19.2 mt -66.04 -38.5 88.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.342 -171.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.432 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -144.81 74.57 14.74 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.834 -0.166 . . . . 0.0 111.385 -178.183 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -67.76 -19.21 47.5 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.393 2.062 . . . . 0.0 111.74 -178.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3645 ' ' ASP . . . . . 0.567 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.5 m-20 -73.5 -51.58 16.6 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.004 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.722 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -77.85 -30.09 50.82 Favored 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -179.58 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.677 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -53.82 -47.34 70.97 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.33 177.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.55 -28.95 68.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.058 0.456 . . . . 0.0 111.148 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 20.1 m -81.44 -33.34 32.16 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.041 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.622 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.8 pt -83.95 -10.44 11.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.235 -178.241 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 38.4 m -55.36 -33.61 63.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.361 176.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -84.0 -33.01 24.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.647 179.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.622 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.5 tp -105.43 38.31 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 122.41 1.1 . . . . 0.0 109.335 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.488 ' N ' ' HD2' ' A' 3655 ' ' PRO . 22.9 t -39.27 -40.84 1.39 Allowed Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 113.996 -1.456 . . . . 0.0 113.606 173.531 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' 3654 ' ' SER . 17.6 Cg_endo -60.21 80.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 121.647 1.565 . . . . 0.0 111.597 168.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3656 ' ' HIS . . . . . 0.414 ' HB2' HD23 ' A' 3579 ' ' LEU . 21.7 p80 -146.72 177.14 9.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.687 -177.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.462 HD22 HG22 ' A' 3628 ' ' ILE . 39.1 mt -122.41 146.93 46.9 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.278 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 61.6 ttp -109.05 107.28 17.55 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 174.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.938 HD12 HD21 ' A' 3524 ' ' LEU . 81.2 mt -99.05 116.35 41.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.295 0.569 . . . . 0.0 111.218 -172.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.656 HG13 ' HD2' ' A' 3573 ' ' TYR . 94.0 t -103.07 113.91 41.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.993 -177.179 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.622 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 62.7 mt -90.56 122.15 41.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.154 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -116.89 127.94 54.76 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.354 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 5.2 p -93.13 131.98 37.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.097 0.475 . . . . 0.0 110.868 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 30.6 t . . . . . 0 C--O 1.244 0.812 0 CA-C-O 118.785 -0.626 . . . . 0.0 110.021 179.231 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.603 ' CD1' ' HB2' ' A' 3553 ' ' MET . 24.5 m-85 . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 111.223 0.083 . . . . 0.0 111.223 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.502 ' CB ' ' HG2' ' A' 3552 ' ' ARG . 0.4 OUTLIER 54.96 -162.04 0.15 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.613 0.721 . . . . 0.0 111.704 177.589 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.498 ' HA ' ' HG2' ' A' 3551 ' ' GLN . 18.7 m -147.3 123.53 10.88 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 168.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.468 ' H ' ' C ' ' A' 3550 ' ' ALA . 34.9 tp . . . . . 0 CA--C 1.512 -0.517 0 C-N-CA 119.54 -0.864 . . . . 0.0 109.956 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.521 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp . . . . . 0 CA--C 1.528 0.101 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.614 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.46 -15.73 62.85 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.683 -172.071 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.614 ' N ' HD13 ' A' 3502 ' ' LEU . 18.6 tptm -74.58 -16.3 60.81 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 44.3 mmtm -105.23 -43.11 5.09 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.818 173.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.729 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.68 102.48 3.45 Favored Pre-proline 0 N--CA 1.447 -0.614 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.24 -178.759 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -85.97 174.25 6.5 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 124.347 3.365 . . . . 0.0 113.602 -178.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.56 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 97.6 mt -71.98 137.18 24.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.938 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 29.6 m -104.24 -24.75 3.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.654 -178.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.634 ' CB ' HD13 ' A' 3538 ' ' LEU . 39.2 t90 -158.22 152.6 24.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.38 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3510 ' ' GLN . . . . . 0.445 ' HG3' ' HB3' ' A' 3523 ' ' GLN . 26.2 tt0 -148.2 119.94 8.08 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -166.54 -128.72 1.0 Allowed Glycine 0 N--CA 1.442 -0.948 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -178.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.7 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.0 mp -139.18 156.63 46.97 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.161 0.505 . . . . 0.0 111.101 178.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.491 HD23 ' HB2' ' A' 3547 ' ' LEU . 72.7 mt -109.48 151.67 26.41 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 169.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.781 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.76 124.04 13.0 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.698 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.702 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.08 142.9 38.14 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 171.91 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.702 ' HD3' HD12 ' A' 3515 ' ' LEU . 2.0 mptp? 63.79 -95.01 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -169.094 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -143.38 9.65 1.64 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.007 -0.997 . . . . 0.0 108.73 175.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.466 ' O ' ' HA ' ' A' 3514 ' ' ALA . 13.4 m-20 -94.89 128.75 41.89 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.164 -175.055 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.482 HG22 ' HB2' ' A' 3514 ' ' ALA . 29.0 p -118.45 134.48 55.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.059 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -129.04 116.37 19.2 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.619 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.48 119.59 14.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.933 0.397 . . . . 0.0 109.955 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' 3579 ' ' LEU . 28.0 m -128.08 147.55 32.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.664 0.745 . . . . 0.0 111.867 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3523 ' ' GLN . . . . . 0.445 ' HB3' ' HG3' ' A' 3510 ' ' GLN . 21.7 pt20 -112.29 125.17 53.88 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.599 -1.182 . . . . 0.0 108.58 173.052 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.827 HD21 HD12 ' A' 3659 ' ' ILE . 0.7 OUTLIER -96.89 112.34 24.14 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.278 0.561 . . . . 0.0 111.851 -174.773 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.56 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 73.5 m-70 -82.98 138.69 33.68 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.113 -0.948 . . . . 0.0 108.646 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.729 ' O ' ' HB2' ' A' 3505 ' ' TYR . 68.5 t80 -66.41 136.34 55.61 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 173.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.566 ' CG1' HD23 ' A' 3575 ' ' LEU . 18.9 t -115.2 -54.56 4.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 121.247 0.546 . . . . 0.0 110.931 177.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.411 ' OG ' HD22 ' A' 3642 ' ' LEU . 28.7 t -159.1 170.42 22.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.124 -169.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.11 -147.11 20.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.23 174.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' A' 3571 ' ' THR . 41.9 t30 -107.6 108.97 20.48 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -63.17 -26.66 68.91 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.706 -175.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 47.4 t -59.27 -32.31 48.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.636 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.518 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 25.2 mt -57.8 -44.6 86.44 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.009 177.133 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -65.0 -42.19 94.69 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 120.765 0.317 . . . . 0.0 110.642 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -58.34 -41.57 84.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.695 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -89.98 -4.95 57.17 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3537 ' ' SER . . . . . . . . . . . . . 13.3 p -104.43 -40.68 5.98 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.891 -0.506 . . . . 0.0 111.514 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.634 HD13 ' CB ' ' A' 3509 ' ' TRP . 22.9 mt -80.32 115.68 56.46 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-O 121.208 0.528 . . . . 0.0 110.874 -172.138 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3539 ' ' PRO . . . . . 0.44 ' HD3' HG21 ' A' 3614 ' ' VAL . 58.6 Cg_endo . . . . . 0 N--CA 1.46 -0.494 0 C-N-CA 123.03 2.487 . . . . 0.0 112.979 -176.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3546 ' ' PRO . . . . . 0.7 ' HA ' ' O ' ' A' 3512 ' ' LEU . 56.4 Cg_endo . . . . . 0 N--CA 1.454 -0.824 0 CA-C-O 121.094 0.372 . . . . 0.0 112.76 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.693 ' HB3' HD13 ' A' 3612 ' ' ILE . 37.1 mt -68.3 109.69 3.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.218 174.157 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.781 ' HA ' ' O ' ' A' 3514 ' ' ALA . 14.9 ptt180 -96.1 139.73 31.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.358 0.599 . . . . 0.0 111.48 -173.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.47 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.8 mt -93.82 107.81 19.75 Favored 'Isoleucine or valine' 0 C--O 1.245 0.848 0 CA-C-O 122.037 0.922 . . . . 0.0 111.603 -172.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.523 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -116.85 5.37 13.0 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.363 -175.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.709 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 42.3 mt-30 -149.4 165.82 30.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.391 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.691 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -155.09 138.31 15.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 0.0 110.923 -179.783 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.555 ' HG3' ' CE2' ' B' 2518 ' ' TYR . 13.7 tmm? -111.25 121.54 45.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.5 177.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -63.01 109.88 1.62 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.631 ' O ' HD12 ' A' 3555 ' ' LEU . 3.4 pp -70.06 99.16 1.41 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 122.5 1.143 . . . . 0.0 109.703 -177.203 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' 3560 ' ' LEU . 8.4 mm-40 -104.91 152.39 22.71 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.291 178.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.576 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -53.25 -48.23 68.4 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 175.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 22.2 m -58.08 -43.84 87.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.597 176.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.551 ' O ' HG23 ' A' 3563 ' ' VAL . 12.1 mm100 -66.06 -45.7 80.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.999 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' 3556 ' ' GLU . 94.0 mt -62.88 -36.38 83.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.447 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' 3557 ' ' ALA . 8.7 mm-40 -56.19 -51.19 68.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.39 172.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -60.9 -41.73 99.4 Favored Glycine 0 CA--C 1.521 0.431 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.548 178.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' 3559 ' ' GLN . 63.1 t -62.6 -48.88 86.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.882 0.372 . . . . 0.0 110.456 177.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.78 -30.92 69.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.71 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.516 ' O ' ' HB ' ' A' 3568 ' ' THR . 34.5 ttm180 -60.53 -40.65 92.26 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.741 0.305 . . . . 0.0 111.192 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -86.6 -10.01 54.84 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.335 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' 3563 ' ' VAL . 83.1 mtp -83.25 -20.51 34.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.961 0.886 . . . . 0.0 108.969 171.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3568 ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' 3565 ' ' ARG . 23.2 m -75.5 -15.54 60.39 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 114.174 -1.376 . . . . 0.0 110.26 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 47.7 t -116.45 90.09 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.987 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.39 108.26 4.17 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.527 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 153.26 -45.48 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 O-C-N 125.057 1.473 . . . . 0.0 107.98 -174.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.08 -30.71 58.42 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.602 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.768 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -126.76 165.79 18.62 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.392 179.269 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.629 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 51.2 t -127.42 134.53 49.88 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 171.047 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.835 HD22 HD13 ' A' 3642 ' ' LEU . 15.2 tp -105.56 126.91 52.68 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.635 HD11 HD11 ' A' 3661 ' ' ILE . 76.9 mt -125.9 154.51 42.65 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.149 0.5 . . . . 0.0 110.934 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.729 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -121.55 108.33 13.48 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.074 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.526 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 123.33 37.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.365 0.602 . . . . 0.0 110.748 -177.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.419 HD23 ' HB2' ' A' 3656 ' ' HIS . 85.5 mt -123.35 143.59 41.64 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.943 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3580 ' ' PRO . . . . . 0.411 ' HA ' ' O ' ' A' 3521 ' ' ALA . 21.5 Cg_endo -61.8 110.99 1.07 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.341 2.028 . . . . 0.0 112.038 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.4 p -95.97 114.33 26.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.337 0.589 . . . . 0.0 110.532 -178.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.93 145.9 16.22 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.542 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3583 ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' 3583 ' ' ARG . 34.1 ttp180 -60.19 -47.69 84.88 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 123.728 0.811 . . . . 0.0 110.73 175.227 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.56 ' O ' HG23 ' A' 3588 ' ' VAL . 2.2 p30 -134.92 179.78 6.1 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.3 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -54.98 -46.65 75.12 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.246 0.341 . . . . 0.0 111.57 -175.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -67.31 -40.82 86.05 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.44 ' HB3' ' H ' ' A' 3584 ' ' ASP . 19.5 t70 -60.61 -42.53 97.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.289 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' 3584 ' ' ASP . 81.1 t -57.46 -49.26 80.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.368 176.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3589 ' ' VAL . . . . . 0.438 ' O ' ' HG2' ' A' 3593 ' ' GLU . 93.7 t -59.66 -49.37 83.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.369 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 29.7 t -59.43 -43.2 93.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.24 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -68.9 -36.09 77.62 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.841 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 88.5 m -63.01 -54.29 40.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.857 0.36 . . . . 0.0 110.78 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.9 pt-20 -62.88 -34.68 77.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.32 -178.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 50.6 m -70.22 -42.09 72.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.647 0.261 . . . . 0.0 110.721 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.594 HD12 ' HB2' ' A' 3599 ' ' PHE . 58.8 tp -63.15 -45.48 91.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.999 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.821 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 21.2 ptmt -67.51 -29.82 69.33 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.657 -0.417 . . . . 0.0 111.161 -178.023 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -80.97 -40.78 23.87 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.745 0.307 . . . . 0.0 111.656 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -90.71 -46.54 8.19 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -171.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.594 ' HB2' HD12 ' A' 3595 ' ' LEU . 9.5 m-85 -98.34 -50.01 4.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.719 0.295 . . . . 0.0 111.323 -174.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.821 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 25.6 mm -60.66 -55.03 27.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.721 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 73.3 m -56.27 -39.79 73.18 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 123.295 0.372 . . . . 0.0 110.977 179.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.79 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -66.68 -57.65 6.73 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.063 179.008 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.79 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.93 -41.25 77.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 -177.704 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -72.9 -37.1 67.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.698 -177.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.16 -33.88 72.32 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.973 0.416 . . . . 0.0 110.848 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -81.16 -19.04 44.26 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.837 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3607 ' ' GLN . . . . . 0.452 ' O ' ' HG ' ' A' 3555 ' ' LEU . 89.8 mt-30 46.31 61.32 2.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.376 0.608 . . . . 0.0 109.582 -168.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.503 ' O ' HD12 ' A' 3603 ' ' LEU . . . -137.84 -177.68 4.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.588 -173.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.691 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -118.19 117.89 30.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.212 173.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.02 101.14 0.45 Allowed Glycine 0 C--O 1.223 -0.571 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.709 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 31.4 mm -89.4 127.7 41.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 121.264 0.554 . . . . 0.0 110.977 -173.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.693 HD13 ' HB3' ' A' 3547 ' ' LEU . 71.5 mt -128.7 105.1 12.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.025 -0.989 . . . . 0.0 109.961 177.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.575 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.6 m120 -81.0 116.84 21.16 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 172.574 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.44 HG21 ' HD3' ' A' 3539 ' ' PRO . 8.0 p . . . . . 0 C--N 1.309 -1.16 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.42 -176.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.575 ' O ' ' HA ' ' A' 3613 ' ' ASN . 92.3 m-85 . . . . . 0 N--CA 1.446 -0.654 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.424 HG13 HG23 ' A' 3611 ' ' ILE . 3.3 t -120.51 113.66 40.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.766 176.006 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.626 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.3 mp -94.98 112.25 23.97 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 171.518 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.458 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 36.8 mt-30 -93.99 110.71 22.38 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.299 -178.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.579 HG12 HG12 ' A' 3659 ' ' ILE . 48.0 mt -90.3 97.86 7.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.954 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -89.13 143.13 30.68 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.823 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.53 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 48.5 Cg_endo -69.12 169.26 18.5 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.305 2.004 . . . . 0.0 111.039 175.51 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -68.64 55.16 0.85 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.115 2.544 . . . . 0.0 112.433 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3632 ' ' CYS . . . . . 0.44 ' O ' ' HG2' ' A' 3636 ' ' GLU . 8.5 p -83.22 162.32 21.25 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.748 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.06 -42.3 76.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.355 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 19.9 t80 -60.41 -40.05 89.62 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.864 0.364 . . . . 0.0 110.272 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 12.4 t -61.33 -59.1 5.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.637 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3636 ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' 3632 ' ' CYS . 7.9 mm-40 -65.19 -34.0 77.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.297 -173.401 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 30.6 t -65.25 -48.72 72.29 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.908 0.385 . . . . 0.0 110.264 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -67.21 -32.02 72.8 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.353 178.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3639 ' ' LEU . . . . . 0.484 ' HB3' HD23 ' A' 3647 ' ' LEU . 65.0 mt -63.16 -40.32 97.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.899 175.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.63 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 38.0 m -63.83 -31.82 73.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.362 0.601 . . . . 0.0 110.153 178.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -80.11 -45.97 17.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.014 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.835 HD13 HD22 ' A' 3575 ' ' LEU . 19.5 mt -82.37 -35.0 28.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.564 -0.744 . . . . 0.0 112.449 -172.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.422 ' HB3' HG13 ' A' 3527 ' ' VAL . . . -147.86 82.57 7.83 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.86 0.362 . . . . 0.0 111.124 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.23 -26.9 48.92 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.804 2.336 . . . . 0.0 113.377 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 8.0 t70 -75.34 -52.12 11.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.096 0.474 . . . . 0.0 110.197 -173.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.729 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -71.14 -29.31 65.07 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.598 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.63 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -55.26 -52.24 64.03 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.811 0.338 . . . . 0.0 110.622 178.064 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.79 -28.61 68.88 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.042 0.449 . . . . 0.0 110.682 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 20.3 m -76.79 -35.19 57.8 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.114 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.582 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.4 pt -83.07 -9.92 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.413 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.5 m -63.85 -16.38 61.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.214 0.53 . . . . 0.0 110.114 175.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 47.4 t30 -87.94 -38.72 15.34 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.904 173.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.582 HG22 ' HA ' ' A' 3650 ' ' ILE . 7.7 tp -105.25 41.08 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 122.527 1.156 . . . . 0.0 109.66 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.474 ' N ' ' HD2' ' A' 3655 ' ' PRO . 14.7 m -38.05 -43.06 1.52 Allowed Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 114.008 -1.451 . . . . 0.0 113.747 172.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' 3654 ' ' SER . 19.6 Cg_endo -61.27 77.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 121.631 1.554 . . . . 0.0 111.818 169.593 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3656 ' ' HIS . . . . . 0.419 ' HB2' HD23 ' A' 3579 ' ' LEU . 25.9 p80 -142.82 174.61 10.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.981 -177.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.486 HD22 HG22 ' A' 3628 ' ' ILE . 36.9 mt -120.63 142.05 49.79 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.301 178.119 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 13.3 tmm? -105.84 109.64 21.66 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.303 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.827 HD12 HD21 ' A' 3524 ' ' LEU . 74.6 mt -105.38 119.05 53.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.264 0.554 . . . . 0.0 111.499 -171.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.768 HG13 ' HD2' ' A' 3573 ' ' TYR . 81.0 t -102.68 116.6 46.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.686 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.635 HD11 HD11 ' A' 3576 ' ' LEU . 54.3 mt -90.53 111.86 24.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.49 128.14 56.34 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 120.97 0.414 . . . . 0.0 111.503 -177.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 8.5 m -74.06 142.11 45.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.714 171.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 84.1 t . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.418 -0.801 . . . . 0.0 109.612 175.452 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.555 ' CE2' ' HG3' ' A' 3553 ' ' MET . 1.5 m-85 . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 120.538 0.208 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.646 ' O ' ' HG2' ' A' 3551 ' ' GLN . 48.4 tt0 59.29 -175.6 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -177.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.403 ' H ' ' HG2' ' B' 2519 ' ' GLU . 6.2 p -140.59 123.83 16.71 Favored 'General case' 0 C--N 1.317 -0.831 0 O-C-N 121.795 -0.566 . . . . 0.0 110.211 178.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.523 ' H ' ' C ' ' A' 3550 ' ' ALA . 20.7 tp . . . . . 0 N--CA 1.452 -0.372 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.245 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.612 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.2 pp . . . . . 0 N--CA 1.457 -0.12 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.611 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.85 -15.46 62.64 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 120.049 -0.661 . . . . 0.0 110.023 -174.258 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.611 ' N ' HD13 ' A' 3502 ' ' LEU . 26.8 tptp -66.77 -33.53 75.83 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.882 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.409 ' HB3' ' CD2' ' A' 3505 ' ' TYR . 22.0 mttp -98.73 -43.72 6.68 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.141 0.496 . . . . 0.0 110.849 178.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.747 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -143.75 97.01 5.49 Favored Pre-proline 0 N--CA 1.441 -0.891 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.379 -176.489 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -81.85 174.17 10.51 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 124.045 3.163 . . . . 0.0 113.533 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.463 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 74.3 mt -71.33 135.79 27.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.647 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.44 HG13 ' HB2' ' A' 3526 ' ' PHE . 32.8 m -109.04 -24.39 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.927 -176.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.716 ' HE3' HD12 ' A' 3524 ' ' LEU . 34.6 t90 -151.3 153.72 35.37 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.673 0.273 . . . . 0.0 110.362 -176.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -150.92 119.76 6.61 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -176.32 -134.02 1.88 Allowed Glycine 0 N--CA 1.445 -0.751 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -136.32 154.45 50.86 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.194 0.521 . . . . 0.0 111.334 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.483 HD23 ' HB2' ' A' 3547 ' ' LEU . 78.1 mt -107.45 152.76 23.78 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 170.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.696 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -148.29 123.64 10.29 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -177.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.614 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.81 143.46 38.91 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 173.117 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.614 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.4 OUTLIER 62.87 -94.97 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 -169.294 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -142.91 10.44 1.77 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 173.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.509 ' O ' ' HA ' ' A' 3514 ' ' ALA . 62.2 m-20 -91.88 128.31 37.68 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.55 -174.756 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.406 HG22 ' HB2' ' A' 3514 ' ' ALA . 11.9 p -119.13 137.74 53.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.337 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -137.26 118.69 14.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.458 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.626 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.96 124.84 26.25 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 177.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 29.5 m -134.4 147.61 29.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.609 0.718 . . . . 0.0 111.862 -175.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3523 ' ' GLN . . . . . 0.54 ' HG2' ' HB3' ' A' 3581 ' ' CYS . 9.1 pt20 -111.47 125.61 54.08 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.023 -0.99 . . . . 0.0 108.709 171.291 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.83 HD21 HD12 ' A' 3659 ' ' ILE . 2.2 mt -93.29 111.68 23.39 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.86 -175.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.463 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 68.2 m-70 -85.05 138.01 32.7 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.209 -0.905 . . . . 0.0 108.897 174.014 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.747 ' O ' ' HB2' ' A' 3505 ' ' TYR . 66.0 t80 -67.59 141.15 56.89 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 173.252 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.587 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.9 t -115.7 -54.91 4.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 121.387 0.613 . . . . 0.0 110.764 174.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.47 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 68.5 m -160.69 172.01 17.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.786 -171.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3529 ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' 3570 ' ' GLU . . . 89.33 -151.11 21.75 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.298 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.565 ' HB2' ' HA ' ' A' 3571 ' ' THR . 39.7 t30 -108.26 117.6 34.58 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.597 0.237 . . . . 0.0 110.5 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.2 p30 -62.69 -29.14 70.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.4 -176.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3532 ' ' VAL . . . . . 0.434 ' HB ' HD21 ' A' 3530 ' ' ASN . 60.2 t -57.93 -34.75 49.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.37 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.423 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 34.2 mt -59.11 -46.22 88.88 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.466 ' HB1' HD12 ' A' 3538 ' ' LEU . . . -66.36 -41.34 89.63 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 120.84 0.352 . . . . 0.0 110.474 -177.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -60.43 -39.18 86.51 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.356 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -89.01 -17.74 28.78 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.487 ' HB2' HD11 ' A' 3626 ' ' LEU . 51.0 p -93.28 -41.61 9.78 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.966 -0.459 . . . . 0.0 110.788 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.684 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.4 mt -80.56 110.39 16.78 Favored Pre-proline 0 C--N 1.32 -0.677 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 -179.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo . . . . . 0 N--CA 1.456 -0.722 0 C-N-CA 122.554 2.169 . . . . 0.0 112.369 -176.918 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo . . . . . 0 C--O 1.236 0.379 0 N-CA-C 111.616 -0.186 . . . . 0.0 111.616 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.678 ' HB3' HD13 ' A' 3612 ' ' ILE . 19.7 mt -69.04 109.23 3.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.263 177.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.696 ' HA ' ' O ' ' A' 3514 ' ' ALA . 18.5 ptt180 -90.98 144.49 25.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.81 0.338 . . . . 0.0 110.902 -178.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.435 HG22 HD22 ' B' 2521 ' ' LEU . 19.6 mt -99.19 110.93 27.48 Favored 'Isoleucine or valine' 0 C--O 1.246 0.874 0 CA-C-O 121.848 0.832 . . . . 0.0 111.12 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.522 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -117.42 5.92 12.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.281 -174.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.669 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 58.9 mt-30 -152.89 170.26 20.79 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.386 0.136 . . . . 0.0 110.935 177.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.714 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -153.18 139.29 18.3 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.744 0.307 . . . . 0.0 111.528 -177.609 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.609 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.7 tmm? -116.88 111.65 19.96 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.839 176.082 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 75.9 mtm-85 -61.07 111.03 1.53 Allowed 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.425 ' O ' HD12 ' A' 3555 ' ' LEU . 1.8 pp -68.53 98.34 0.86 Allowed 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.071 0.939 . . . . 0.0 109.545 -176.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.607 ' O ' ' HG ' ' A' 3560 ' ' LEU . 13.0 mm-40 -109.62 164.35 12.61 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.643 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -53.34 -51.39 62.57 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.884 0.373 . . . . 0.0 111.447 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 21.0 p -65.42 -36.56 84.29 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.982 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.499 ' O ' HG23 ' A' 3563 ' ' VAL . 16.0 mm100 -64.91 -37.83 88.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.753 178.093 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' 3556 ' ' GLU . 86.4 mt -64.85 -31.33 72.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.648 179.259 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -67.12 -44.25 80.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.206 0.527 . . . . 0.0 110.098 173.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -56.16 -45.46 87.72 Favored Glycine 0 CA--C 1.518 0.225 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.819 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.576 ' O ' ' HG2' ' A' 3566 ' ' ARG . 60.0 t -62.55 -43.63 98.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 0.0 110.342 176.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -56.8 -39.87 74.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.26 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.61 ' O ' ' HB ' ' A' 3568 ' ' THR . 45.8 ttt180 -58.33 -44.11 88.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.678 0.275 . . . . 0.0 111.469 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3566 ' ' ARG . . . . . 0.576 ' HG2' ' O ' ' A' 3563 ' ' VAL . 5.7 ptp180 -76.69 -20.07 57.0 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.49 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.572 ' HG2' ' CE2' ' A' 3573 ' ' TYR . 81.3 mtp -84.61 -11.74 55.37 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.319 0.581 . . . . 0.0 109.964 175.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3568 ' ' THR . . . . . 0.61 ' HB ' ' O ' ' A' 3565 ' ' ARG . 3.3 m -74.8 -23.93 58.57 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.171 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 60.6 t -126.58 101.27 7.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.257 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3570 ' ' GLU . . . . . 0.438 ' HB3' ' HA2' ' A' 3529 ' ' GLY . 44.9 mt-10 -75.72 109.0 8.95 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.565 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.2 m 148.55 -38.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.646 1.578 . . . . 0.0 107.287 -172.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.85 -27.53 40.12 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.238 176.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.746 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -131.36 164.0 26.63 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.064 176.237 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.641 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 47.7 t -127.74 135.43 50.13 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 171.315 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.731 HD22 HD13 ' A' 3642 ' ' LEU . 13.6 tp -104.67 125.66 51.0 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.578 HD11 HD11 ' A' 3661 ' ' ILE . 64.5 mt -126.18 158.2 36.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.245 0.545 . . . . 0.0 111.217 -176.057 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.54 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -126.13 107.93 10.86 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.699 178.79 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.508 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.83 123.04 38.06 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.251 0.548 . . . . 0.0 110.626 -177.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.438 HD21 HG22 ' A' 3650 ' ' ILE . 83.4 mt -123.02 142.56 38.48 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.299 -179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3580 ' ' PRO . . . . . 0.412 ' HA ' ' O ' ' A' 3521 ' ' ALA . 19.7 Cg_endo -61.87 112.11 1.4 Allowed 'Trans proline' 0 C--O 1.234 0.312 0 C-N-CA 122.382 2.055 . . . . 0.0 111.835 178.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3581 ' ' CYS . . . . . 0.54 ' HB3' ' HG2' ' A' 3523 ' ' GLN . 28.9 p -98.7 120.25 38.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.005 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3582 ' ' GLY . . . . . 0.469 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -97.52 142.69 16.29 Favored Glycine 0 N--CA 1.439 -1.111 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.536 -178.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 45.2 mtt85 -66.32 -31.42 72.2 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.037 0.922 . . . . 0.0 109.041 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.577 ' O ' HG23 ' A' 3588 ' ' VAL . 28.7 t70 -144.93 170.04 16.91 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.062 -1.426 . . . . 0.0 107.739 176.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -56.5 -38.11 71.31 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 118.203 0.456 . . . . 0.0 110.347 177.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -61.05 -46.72 89.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.383 0.611 . . . . 0.0 109.765 176.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.598 ' O ' ' HG2' ' A' 3591 ' ' GLN . 6.2 t70 -60.5 -44.75 95.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.173 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' 3584 ' ' ASP . 86.9 t -52.18 -41.37 33.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.104 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3589 ' ' VAL . . . . . 0.447 ' O ' ' HG2' ' A' 3593 ' ' GLU . 3.6 t -63.82 -52.32 58.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.685 0.755 . . . . 0.0 109.399 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 71.6 m -58.22 -43.83 87.91 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.116 -1.402 . . . . 0.0 111.977 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3591 ' ' GLN . . . . . 0.598 ' HG2' ' O ' ' A' 3587 ' ' ASP . 18.1 mm-40 -68.61 -41.31 79.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.038 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 83.2 m -61.45 -52.42 64.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.095 -178.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.1 pt-20 -67.23 -32.75 74.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.288 -178.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 28.1 t -64.78 -46.38 82.35 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 176.214 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.557 HD12 ' HB2' ' A' 3599 ' ' PHE . 52.0 tp -63.76 -46.2 86.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.231 -178.303 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.79 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.7 -29.26 69.78 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.493 -175.973 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 3597 ' ' ALA . . . . . 0.457 ' O ' ' HB ' ' A' 3601 ' ' THR . . . -85.91 -42.38 14.13 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.908 0.385 . . . . 0.0 111.256 179.132 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.426 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -85.24 -45.85 11.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -170.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.557 ' HB2' HD12 ' A' 3595 ' ' LEU . 15.1 m-85 -99.34 -50.41 4.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.704 0.288 . . . . 0.0 111.18 -176.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.79 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 26.3 mm -61.38 -55.78 22.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.066 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3601 ' ' THR . . . . . 0.457 ' HB ' ' O ' ' A' 3597 ' ' ALA . 74.4 m -60.43 -38.27 83.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.687 0.28 . . . . 0.0 111.221 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.775 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -67.05 -55.84 12.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.687 178.336 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.775 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.82 -41.98 78.8 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -178.354 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -70.74 -37.81 73.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.594 -177.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.13 -38.53 82.3 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 121.085 0.469 . . . . 0.0 110.626 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3606 ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' 3602 ' ' TYR . 69.6 mmtt -77.5 -19.43 55.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.482 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 49.9 49.94 19.34 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.625 -169.118 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.523 ' O ' HD12 ' A' 3603 ' ' LEU . . . -128.5 -175.48 3.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.362 0.601 . . . . 0.0 112.169 -171.074 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.714 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.67 117.82 29.28 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.239 175.307 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.02 102.55 0.59 Allowed Glycine 0 C--O 1.221 -0.666 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 176.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.669 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.3 mm -89.21 121.4 39.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 121.204 0.526 . . . . 0.0 110.84 -174.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.678 HD13 ' HB3' ' A' 3547 ' ' LEU . 57.6 mt -117.87 105.38 17.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.444 175.139 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 18.3 m120 -87.41 115.32 24.74 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.867 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.314 -0.939 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.583 -177.127 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 3624 ' ' TYR . . . . . . . . . . . . . 85.5 m-85 . . . . . 0 CA--C 1.513 -0.477 0 CA-C-O 121.134 0.492 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 4.2 t -124.84 117.27 49.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.003 178.563 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.631 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -98.17 112.25 24.29 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 170.264 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.485 ' HB3' ' HB1' ' A' 3609 ' ' ALA . 34.0 mt-30 -94.72 110.47 22.31 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.658 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.588 HG12 HG12 ' A' 3659 ' ' ILE . 38.7 mt -92.14 98.06 7.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.027 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3629 ' ' PHE . . . . . 0.63 ' HB2' ' HE3' ' A' 3658 ' ' MET . 97.5 m-85 -89.78 147.67 38.11 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.764 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.449 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.8 Cg_endo -70.35 171.02 15.91 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.364 2.043 . . . . 0.0 111.134 175.583 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.37 42.04 0.45 Allowed 'Trans proline' 0 CA--C 1.532 0.425 0 C-N-CA 123.025 2.483 . . . . 0.0 112.603 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 24.8 p -72.56 163.36 28.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.151 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -44.95 -47.97 11.37 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 123.721 0.638 . . . . 0.0 110.937 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 26.6 t80 -48.95 -55.43 11.88 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.653 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3635 ' ' SER . . . . . 0.49 ' HA ' ' HE2' ' A' 3658 ' ' MET . 19.7 m -56.58 -58.09 9.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.979 -177.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -60.81 -35.43 76.49 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.388 -174.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 66.4 m -57.34 -61.99 2.09 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.072 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -69.83 -20.36 63.44 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.143 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 62.8 mt -66.03 -35.97 81.99 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.364 174.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.803 ' HA ' HD22 ' A' 3647 ' ' LEU . 15.3 m -69.6 -35.31 75.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.321 0.581 . . . . 0.0 110.467 178.502 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -81.14 -37.79 28.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.058 -178.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.731 HD13 HD22 ' A' 3575 ' ' LEU . 15.7 mt -89.37 -31.11 17.93 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -174.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.433 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -153.0 72.53 7.11 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -176.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3644 ' ' PRO . . . . . 0.627 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 50.3 Cg_endo -70.87 -17.17 32.73 Favored 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 122.152 1.901 . . . . 0.0 111.856 177.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3645 ' ' ASP . . . . . 0.518 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 40.1 m-20 -72.73 -45.0 60.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.177 -177.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.612 ' HB2' HD13 ' A' 3501 ' ' LEU . 0.1 OUTLIER -83.09 -28.79 29.24 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 176.634 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.803 HD22 ' HA ' ' A' 3640 ' ' SER . 22.4 tp -50.54 -47.05 57.8 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.546 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.15 -19.01 61.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.945 0.402 . . . . 0.0 111.705 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 36.6 m -89.69 -31.05 17.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.839 0.352 . . . . 0.0 110.824 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.546 ' HA ' HG22 ' A' 3653 ' ' ILE . 6.5 pt -85.83 -13.77 10.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.623 -178.21 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 47.4 m -59.48 -22.17 61.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.795 0.331 . . . . 0.0 111.222 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -88.02 -38.37 15.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.481 0.658 . . . . 0.0 109.758 174.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.568 HD12 ' HG2' ' A' 3655 ' ' PRO . 8.2 tp -105.26 42.4 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 122.288 1.042 . . . . 0.0 109.408 -178.16 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.486 ' N ' ' HD2' ' A' 3655 ' ' PRO . 42.0 m -40.37 -42.0 2.86 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 114.384 -1.28 . . . . 0.0 113.148 171.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.568 ' HG2' HD12 ' A' 3653 ' ' ILE . 11.2 Cg_endo -58.15 83.45 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.635 1.557 . . . . 0.0 111.404 167.192 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.0 p-80 -149.26 169.71 20.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.253 -177.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.52 HD22 HG22 ' A' 3628 ' ' ILE . 46.3 mt -117.57 132.83 56.46 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.581 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3658 ' ' MET . . . . . 0.63 ' HE3' ' HB2' ' A' 3629 ' ' PHE . 9.5 tmm? -99.61 109.82 22.3 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 177.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.83 HD12 HD21 ' A' 3524 ' ' LEU . 74.2 mt -107.31 121.48 60.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 121.281 0.562 . . . . 0.0 111.566 -170.152 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.746 HG13 ' HD2' ' A' 3573 ' ' TYR . 91.8 t -104.56 113.8 42.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.727 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.641 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 58.3 mt -91.02 115.53 30.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.829 177.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -124.47 132.51 53.49 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.834 -0.346 . . . . 0.0 111.622 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 24.7 m -86.03 112.44 21.24 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 171.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.533 -178.65 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.609 ' CD1' ' HB2' ' A' 3553 ' ' MET . 57.0 m-85 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.565 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.6 OUTLIER 56.13 -162.02 0.18 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.829 0.823 . . . . 0.0 111.848 176.69 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 25.7 m -146.32 117.88 8.02 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 114.613 -1.176 . . . . 0.0 108.032 168.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.545 HD13 ' HD2' ' A' 3552 ' ' ARG . 24.4 tp . . . . . 0 N--CA 1.449 -0.505 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.042 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.587 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp . . . . . 0 C--O 1.233 0.233 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.592 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.37 -15.56 63.75 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.546 -174.065 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.592 ' N ' HD13 ' A' 3502 ' ' LEU . 13.7 mptt -57.41 -42.64 82.69 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.212 173.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.477 ' HB3' ' CD2' ' A' 3505 ' ' TYR . 5.1 tmtm? -95.45 -38.6 10.39 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.315 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.737 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -147.06 101.39 3.87 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-O 121.302 0.572 . . . . 0.0 111.629 -177.422 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -86.23 174.02 6.38 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 124.158 3.239 . . . . 0.0 113.723 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.48 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 88.2 mt -71.88 131.34 34.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.243 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 29.3 m -100.96 -28.82 3.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.466 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.671 ' HE3' HD12 ' A' 3524 ' ' LEU . 14.0 t90 -153.11 155.05 36.05 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 110.229 -0.285 . . . . 0.0 110.229 -175.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -150.95 119.93 6.67 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.74 -130.52 1.23 Allowed Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 -178.55 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -136.87 152.71 50.54 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.359 0.6 . . . . 0.0 111.437 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.48 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 72.6 mt -105.53 153.61 21.51 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 168.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.666 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -146.64 124.07 11.67 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -177.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.785 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.3 144.61 38.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.687 172.674 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.785 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.7 OUTLIER 59.36 -93.56 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 122.964 0.506 . . . . 0.0 110.293 -170.898 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 20.2 m120 -141.78 7.31 1.86 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.842 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -104.51 129.67 52.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.115 0.484 . . . . 0.0 111.205 -177.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.613 HG22 ' HB2' ' A' 3514 ' ' ALA . 18.0 p -108.96 154.81 21.64 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.509 176.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -143.97 113.49 7.03 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.776 175.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.636 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.52 115.87 10.2 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.115 0.483 . . . . 0.0 110.059 177.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 28.0 m -129.67 147.77 33.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.582 0.706 . . . . 0.0 111.795 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3523 ' ' GLN . . . . . 0.428 ' HG2' ' HB3' ' A' 3581 ' ' CYS . 3.8 pt20 -108.59 125.73 52.16 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.021 -0.99 . . . . 0.0 108.861 172.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.879 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -93.07 111.37 22.98 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.421 0.629 . . . . 0.0 111.716 -175.957 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.48 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 70.2 m-70 -87.65 136.56 32.9 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.878 -1.055 . . . . 0.0 108.595 175.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.737 ' O ' ' HB2' ' A' 3505 ' ' TYR . 63.9 t80 -64.77 141.09 58.89 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.589 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.1 t -115.3 -58.36 3.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 CA-C-O 121.386 0.612 . . . . 0.0 110.64 174.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.502 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 58.3 m -160.74 171.66 18.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.197 -171.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.59 -149.0 20.29 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.516 -0.849 . . . . 0.0 112.609 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.563 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.0 t-20 -101.6 111.54 23.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.599 0.237 . . . . 0.0 110.494 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -61.15 -31.7 71.42 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.589 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 23.6 t -63.16 -32.3 55.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.508 -178.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.565 HD23 ' HD3' ' A' 3536 ' ' ARG . 28.8 mt -57.59 -39.44 76.81 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.086 177.474 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.473 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -67.38 -46.85 72.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.921 0.391 . . . . 0.0 110.297 179.288 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -63.58 -27.66 69.4 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.286 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.565 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.8 ptm180 -90.32 -14.92 32.18 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.452 ' O ' HG21 ' A' 3614 ' ' VAL . 21.7 p -103.78 -38.23 7.14 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.854 0.359 . . . . 0.0 111.949 -179.322 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.635 HD13 ' HB2' ' A' 3509 ' ' TRP . 19.4 mt -79.98 121.04 81.63 Favored Pre-proline 0 C--N 1.317 -0.815 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -175.063 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3539 ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' 3538 ' ' LEU . 6.6 Cg_endo . . . . . 0 N--CA 1.456 -0.708 0 C-N-CA 122.592 2.194 . . . . 0.0 113.667 -173.539 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo . . . . . 0 N--CA 1.46 -0.446 0 CA-C-O 120.859 0.275 . . . . 0.0 112.018 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.666 ' HB3' HD13 ' A' 3612 ' ' ILE . 56.6 mt -74.09 112.25 10.04 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.932 177.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.666 ' HA ' ' O ' ' A' 3514 ' ' ALA . 16.2 ptt-85 -103.16 142.52 34.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.149 0.499 . . . . 0.0 111.003 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.483 HG22 HD12 ' B' 2521 ' ' LEU . 33.2 mt -95.86 108.76 21.58 Favored 'Isoleucine or valine' 0 C--O 1.245 0.855 0 CA-C-O 121.878 0.847 . . . . 0.0 112.016 -171.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.496 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.3 -1.28 15.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.966 -176.082 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.673 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 41.6 mt-30 -149.95 170.66 18.31 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.423 0.154 . . . . 0.0 111.038 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.719 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.14 141.21 17.34 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.934 0.397 . . . . 0.0 111.193 -179.68 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.601 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -110.6 121.39 45.2 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.402 178.239 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -63.34 110.68 1.99 Allowed 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.612 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -70.16 99.54 1.51 Allowed 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 122.152 0.977 . . . . 0.0 109.791 -178.103 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.597 ' O ' ' HG ' ' A' 3560 ' ' LEU . 38.5 mt-10 -112.91 160.08 18.42 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.634 -1.166 . . . . 0.0 109.659 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.607 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -52.53 -52.36 55.12 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.414 0.446 . . . . 0.0 111.202 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 7.0 p -58.85 -42.38 89.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.42 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.547 ' O ' HG23 ' A' 3563 ' ' VAL . 13.9 mm100 -62.1 -48.07 81.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.035 177.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' 3556 ' ' GLU . 87.0 mt -61.05 -34.46 74.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.404 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' A' 3557 ' ' ALA . 29.6 mm-40 -59.38 -51.89 67.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.174 0.511 . . . . 0.0 109.878 175.635 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.31 -38.89 96.44 Favored Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.312 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' 3559 ' ' GLN . 83.9 t -61.24 -56.39 18.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.535 0.207 . . . . 0.0 110.644 178.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3564 ' ' ALA . . . . . 0.404 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -65.23 -29.03 69.79 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -175.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.416 ' NH1' ' HB3' ' A' 3561 ' ' GLU . 72.2 mtt180 -75.9 -22.83 55.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3566 ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' 3563 ' ' VAL . 36.4 ptt180 -89.49 -12.32 40.4 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.669 169.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.536 ' HG3' ' O ' ' A' 3563 ' ' VAL . 78.1 mtp -81.72 -19.06 42.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.785 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 21.8 p -75.09 -19.23 60.06 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.408 0.623 . . . . 0.0 110.081 176.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.7 t -95.93 79.52 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.002 177.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.65 108.41 2.89 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.563 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 153.44 -43.24 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.52 1.528 . . . . 0.0 108.053 -175.179 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.25 -30.65 34.05 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.832 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.718 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -125.69 165.31 18.83 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.172 -179.891 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.625 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 25.4 t -127.09 135.79 51.25 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 171.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.762 HD22 HD13 ' A' 3642 ' ' LEU . 13.9 tp -106.16 125.17 50.66 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 178.736 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.61 HD11 HD11 ' A' 3661 ' ' ILE . 79.1 mt -127.19 151.78 48.24 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.149 0.499 . . . . 0.0 110.755 -177.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.698 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.03 108.68 14.59 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.512 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.39 122.4 36.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.304 0.573 . . . . 0.0 110.431 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.621 HD21 HG22 ' A' 3650 ' ' ILE . 82.5 mt -122.13 140.83 33.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.184 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.88 112.72 1.44 Allowed 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.393 2.062 . . . . 0.0 111.819 178.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3581 ' ' CYS . . . . . 0.428 ' HB3' ' HG2' ' A' 3523 ' ' GLN . 25.7 p -99.75 118.47 36.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.116 0.484 . . . . 0.0 110.293 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3582 ' ' GLY . . . . . 0.429 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.33 145.57 16.26 Favored Glycine 0 N--CA 1.442 -0.948 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.652 -178.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -76.87 -31.23 56.66 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.907 0.86 . . . . 0.0 109.353 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.562 ' H ' ' HB3' ' A' 3587 ' ' ASP . 22.8 t70 -134.47 167.66 20.36 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.346 -178.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -54.6 -43.55 72.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.005 0.431 . . . . 0.0 110.348 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.32 -33.68 71.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.176 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.562 ' HB3' ' H ' ' A' 3584 ' ' ASP . 6.8 t70 -64.93 -42.77 94.39 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' 3584 ' ' ASP . 93.8 t -56.28 -50.96 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.202 176.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 75.1 t -58.21 -50.51 78.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.695 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 42.1 t -55.43 -51.12 67.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.319 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -65.73 -36.98 85.13 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 121.22 -0.192 . . . . 0.0 111.225 -177.459 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3592 ' ' THR . . . . . 0.446 ' O ' ' HB3' ' A' 3596 ' ' LYS . 49.2 m -64.41 -44.71 90.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.957 0.408 . . . . 0.0 110.181 176.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.453 ' HA ' ' CE ' ' A' 3596 ' ' LYS . 12.9 tp10 -61.01 -47.16 87.73 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.604 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 39.4 m -65.85 -47.72 73.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.047 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.554 HD12 ' HB2' ' A' 3599 ' ' PHE . 59.6 tp -59.5 -44.15 93.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.87 0.367 . . . . 0.0 110.73 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.695 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.9 OUTLIER -62.59 -35.76 80.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.262 -178.033 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3597 ' ' ALA . . . . . 0.417 ' O ' ' HB ' ' A' 3601 ' ' THR . . . -83.59 -41.18 18.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.728 0.299 . . . . 0.0 111.725 -178.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.494 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -86.57 -46.27 10.29 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -170.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.554 ' HB2' HD12 ' A' 3595 ' ' LEU . 19.6 m-85 -99.45 -50.5 4.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.711 0.291 . . . . 0.0 111.166 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.695 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.2 mm -60.88 -57.01 14.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.664 -176.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3601 ' ' THR . . . . . 0.417 ' HB ' ' O ' ' A' 3597 ' ' ALA . 91.7 m -56.29 -49.11 75.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.022 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.663 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -59.52 -57.33 13.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.158 -179.489 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.663 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.3 OUTLIER -55.83 -42.28 75.49 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -178.52 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -75.85 -40.03 55.49 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.848 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -66.1 -46.43 77.64 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.988 0.423 . . . . 0.0 110.97 -178.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -77.74 -11.59 59.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.281 -178.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 50.36 63.22 2.29 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.255 -174.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.558 ' O ' HD12 ' A' 3603 ' ' LEU . . . -138.35 -176.28 4.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.213 0.53 . . . . 0.0 112.317 -173.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.719 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -122.89 117.78 26.37 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.33 174.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3610 ' ' GLY . . . . . 0.449 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.36 103.7 0.78 Allowed Glycine 0 C--O 1.222 -0.621 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.499 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.673 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 28.8 mm -89.42 124.33 42.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 121.212 0.53 . . . . 0.0 110.659 -175.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.666 HD13 ' HB3' ' A' 3547 ' ' LEU . 62.1 mt -124.2 105.99 16.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.108 177.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' 3624 ' ' TYR . 7.1 m120 -80.77 112.31 18.03 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.485 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.452 HG21 ' O ' ' A' 3537 ' ' SER . 6.2 p . . . . . 0 C--N 1.311 -1.068 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.815 -177.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.51 ' O ' ' HA ' ' A' 3613 ' ' ASN . 78.7 m-85 . . . . . 0 C--O 1.239 0.521 0 CA-C-O 120.691 0.282 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 20.1 t -116.1 114.98 47.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.935 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.599 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -99.45 115.44 29.28 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 168.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.501 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 97.9 mt-30 -94.66 111.32 23.09 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.04 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.594 HG12 HG12 ' A' 3659 ' ' ILE . 43.9 mt -90.46 98.46 8.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.961 178.096 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -88.48 145.04 34.66 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.085 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.558 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.3 Cg_endo -69.91 172.84 12.04 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.744 2.296 . . . . 0.0 111.901 177.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -70.88 46.69 0.66 Allowed 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 122.97 2.447 . . . . 0.0 112.272 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.5 p -80.66 162.63 24.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.276 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3633 ' ' GLU . . . . . 0.41 ' H ' ' CD ' ' A' 3633 ' ' GLU . 3.3 mp0 -53.73 -38.96 64.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.012 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 32.0 t80 -49.69 -50.04 45.26 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 121.284 0.564 . . . . 0.0 110.95 174.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 4.1 m -64.95 -52.9 53.77 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.153 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -52.19 -50.65 61.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.143 -176.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 51.3 p -60.56 -50.45 73.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.174 0.512 . . . . 0.0 110.711 -175.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 72.1 m80 -66.3 -36.24 82.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.975 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 76.4 mt -64.29 -34.67 78.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.052 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.989 ' HA ' HD22 ' A' 3647 ' ' LEU . 34.8 m -64.12 -37.1 86.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.224 0.535 . . . . 0.0 110.412 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.82 -51.11 9.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.202 178.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.762 HD13 HD22 ' A' 3575 ' ' LEU . 30.1 mt -72.45 -34.39 67.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.789 -171.342 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.422 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -151.35 84.39 5.22 Favored Pre-proline 0 C--N 1.328 -0.334 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -73.52 -23.12 17.56 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.6 2.2 . . . . 0.0 113.372 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 12.3 t0 -76.46 -52.91 8.91 Favored 'General case' 0 CA--C 1.515 -0.365 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 -175.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.698 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -69.79 -28.32 65.64 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 178.625 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.989 HD22 ' HA ' ' A' 3640 ' ' SER . 31.7 tp -51.12 -50.13 59.45 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.914 174.482 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.33 -23.75 65.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.179 -178.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 12.9 m -83.43 -36.38 24.26 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.436 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.621 HG22 HD21 ' A' 3579 ' ' LEU . 4.3 pt -81.31 -17.28 12.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.487 -177.09 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 49.6 m -58.44 -22.55 54.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.91 175.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -89.28 -37.09 15.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.016 0.436 . . . . 0.0 110.787 174.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.582 HG22 ' HA ' ' A' 3650 ' ' ILE . 7.5 tp -104.51 39.76 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 122.473 1.13 . . . . 0.0 109.307 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.464 ' N ' ' HD2' ' A' 3655 ' ' PRO . 20.2 m -35.53 -44.57 0.84 Allowed Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 113.784 -1.553 . . . . 0.0 114.038 173.156 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' 3654 ' ' SER . 20.2 Cg_endo -62.46 76.12 0.1 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.541 1.494 . . . . 0.0 112.008 171.199 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 34.6 p80 -145.65 175.47 10.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.121 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.478 HD22 HG22 ' A' 3628 ' ' ILE . 21.6 mt -120.6 152.32 38.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.77 -177.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 57.4 ttp -112.0 109.51 19.31 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.879 HD12 HD21 ' A' 3524 ' ' LEU . 81.1 mt -102.67 116.63 46.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 121.317 0.58 . . . . 0.0 111.325 -172.538 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.718 HG13 ' HD2' ' A' 3573 ' ' TYR . 82.1 t -102.47 115.28 44.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.023 -178.19 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.625 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 64.3 mt -90.9 121.85 41.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -123.68 126.54 46.75 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.722 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.5 m -104.93 110.47 22.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.832 169.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.03 -178.276 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.601 ' CD1' ' HB2' ' A' 3553 ' ' MET . 31.9 m-85 . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.516 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.5 OUTLIER 54.22 -162.97 0.12 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 122.022 0.915 . . . . 0.0 112.16 177.318 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 1.2 p -144.25 116.72 8.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.096 -1.411 . . . . 0.0 108.225 167.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.608 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.512 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.1 pp . . . . . 0 N--CA 1.453 -0.307 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.64 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.76 -17.32 64.5 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.436 -174.107 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.64 ' N ' HD13 ' A' 3502 ' ' LEU . 22.8 tptm -68.42 -28.15 66.82 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.065 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.418 ' HA ' ' HD2' ' A' 3504 ' ' LYS . 32.0 tptt -103.17 -42.29 5.81 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.257 0.551 . . . . 0.0 109.894 179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.742 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -146.26 97.16 4.45 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.553 -178.219 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -79.67 173.06 13.44 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.573 2.848 . . . . 0.0 113.524 -176.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.535 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.0 mt -73.0 137.2 23.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.132 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.44 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.5 m -105.11 -31.37 2.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.654 -178.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.773 ' HE3' HD12 ' A' 3524 ' ' LEU . 18.2 t90 -145.33 155.69 43.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.793 0.33 . . . . 0.0 110.825 -174.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -150.56 120.6 7.19 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 176.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -174.18 -132.32 1.53 Allowed Glycine 0 N--CA 1.444 -0.818 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -178.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.639 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.4 mp -138.1 155.69 48.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.058 0.456 . . . . 0.0 110.989 178.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.534 HD23 ' HB2' ' A' 3547 ' ' LEU . 91.2 mt -109.03 146.15 34.41 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 169.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.708 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.37 126.84 16.82 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.465 0.174 . . . . 0.0 110.918 -179.224 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.785 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.53 141.4 39.32 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 172.619 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.785 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 62.85 -86.99 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.196 0.598 . . . . 0.0 109.908 -171.532 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 49.4 m-20 -149.81 11.9 0.76 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.185 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.437 ' O ' ' HA ' ' A' 3514 ' ' ALA . 16.5 m-20 -103.0 139.4 38.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.358 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.522 HG22 ' HB2' ' A' 3514 ' ' ALA . 37.5 p -127.12 143.13 51.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.108 0.48 . . . . 0.0 111.71 -175.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -139.55 114.69 9.65 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.396 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.616 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -68.97 120.61 15.11 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 177.563 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.438 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 31.4 m -129.87 148.28 33.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 121.582 0.706 . . . . 0.0 112.181 -174.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -108.72 125.52 52.0 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 114.849 -1.068 . . . . 0.0 108.827 171.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.861 HD21 HD12 ' A' 3659 ' ' ILE . 2.1 mt -93.98 114.2 26.35 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.371 0.605 . . . . 0.0 111.637 -176.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.535 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 48.3 m80 -89.5 142.4 27.7 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.747 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.742 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.1 t80 -70.32 135.28 48.73 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 171.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.604 ' CG1' HD23 ' A' 3575 ' ' LEU . 24.3 t -114.33 -57.0 3.99 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-O 121.467 0.651 . . . . 0.0 110.283 176.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.574 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 66.1 m -160.0 171.21 19.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.111 -172.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 86.3 -152.57 25.61 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.432 -0.89 . . . . 0.0 111.744 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.554 ' HB2' ' HA ' ' A' 3571 ' ' THR . 3.4 t-20 -102.13 117.76 35.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.115 0.458 . . . . 0.0 110.758 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -65.24 -28.56 69.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.176 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3532 ' ' VAL . . . . . 0.4 ' HB ' ' OD1' ' A' 3530 ' ' ASN . 61.0 t -59.52 -33.13 50.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.477 178.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.57 HD23 ' HD3' ' A' 3536 ' ' ARG . 18.7 mt -58.94 -41.55 87.64 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.092 177.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.489 ' HB1' HD12 ' A' 3538 ' ' LEU . . . -69.23 -40.0 78.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.935 0.397 . . . . 0.0 110.361 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -65.45 -32.68 74.42 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.76 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.57 ' HD3' HD23 ' A' 3533 ' ' LEU . 11.2 ptm180 -90.13 -11.63 40.64 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3537 ' ' SER . . . . . . . . . . . . . 26.7 p -104.12 -43.33 5.28 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.542 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.7 HD13 ' HB2' ' A' 3509 ' ' TRP . 35.8 mt -78.82 111.94 23.45 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-O 121.228 0.537 . . . . 0.0 110.033 -172.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3539 ' ' PRO . . . . . 0.513 ' HD3' HG21 ' A' 3614 ' ' VAL . 97.3 Cg_endo . . . . . 0 N--CA 1.453 -0.891 0 C-N-CA 123.101 2.534 . . . . 0.0 112.793 -172.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3546 ' ' PRO . . . . . 0.639 ' HA ' ' O ' ' A' 3512 ' ' LEU . 19.6 Cg_endo . . . . . 0 N--CA 1.453 -0.872 0 N-CA-C 113.455 0.521 . . . . 0.0 113.455 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.647 ' HB3' HD13 ' A' 3612 ' ' ILE . 26.7 mt -79.32 122.98 27.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.637 172.398 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.708 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -102.84 143.85 31.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 111.816 -174.571 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.517 HG22 HD12 ' B' 2521 ' ' LEU . 21.8 mt -98.93 107.45 20.52 Favored 'Isoleucine or valine' 0 C--O 1.248 0.978 0 CA-C-O 122.251 1.024 . . . . 0.0 111.903 -174.055 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.539 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -114.79 1.96 14.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.972 -174.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.678 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 66.8 mt-30 -148.99 172.47 14.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.476 0.179 . . . . 0.0 111.209 178.05 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.739 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.75 139.91 15.53 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.082 0.468 . . . . 0.0 111.621 -179.273 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.69 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 19.4 ttt -108.17 125.46 51.65 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.352 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -64.0 111.25 2.43 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 177.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.568 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -76.57 98.56 4.71 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 122.413 1.102 . . . . 0.0 109.476 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' 3560 ' ' LEU . 44.1 mt-10 -108.22 159.06 16.91 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.29 176.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -58.64 -41.69 86.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.473 0.654 . . . . 0.0 109.277 175.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3558 ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' 3561 ' ' GLU . 0.7 OUTLIER -62.27 -41.23 98.28 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.827 177.882 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.54 ' O ' HG23 ' A' 3563 ' ' VAL . 17.2 mm-40 -70.28 -41.53 73.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.698 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' 3556 ' ' GLU . 85.4 mt -61.58 -35.31 77.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.501 178.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' 3558 ' ' THR . 45.2 mm-40 -55.28 -51.35 66.94 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.136 172.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.37 -44.39 98.11 Favored Glycine 0 CA--C 1.519 0.29 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.432 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' 3559 ' ' GLN . 57.3 t -59.54 -52.43 61.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.503 0.192 . . . . 0.0 110.616 179.01 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3564 ' ' ALA . . . . . 0.546 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.96 -32.25 71.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.026 0.441 . . . . 0.0 111.046 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.478 ' O ' HG22 ' A' 3568 ' ' THR . 41.8 ttp180 -63.06 -38.27 90.52 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.167 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3566 ' ' ARG . . . . . 0.463 HH22 ' HH ' ' B' 2518 ' ' TYR . 25.2 ptt180 -88.5 -10.86 47.54 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.899 -0.32 . . . . 0.0 111.282 175.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.546 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 65.0 mtp -80.14 -26.55 39.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.975 177.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3568 ' ' THR . . . . . 0.478 HG22 ' O ' ' A' 3565 ' ' ARG . 8.5 t -74.73 -9.43 58.55 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.983 0.42 . . . . 0.0 110.834 -177.536 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 40.8 t -111.26 87.63 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.302 0.572 . . . . 0.0 110.236 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.15 110.42 4.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.178 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.554 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.6 m 150.94 -40.62 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.747 1.619 . . . . 0.0 107.825 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -80.69 -30.83 36.41 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.629 -179.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.667 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -126.72 166.5 17.28 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.058 178.626 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.622 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 33.7 t -129.27 135.81 49.26 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 171.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.778 HD22 HD13 ' A' 3642 ' ' LEU . 9.4 tp -105.87 124.8 50.15 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 177.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.58 HD11 HD11 ' A' 3661 ' ' ILE . 80.9 mt -125.1 158.1 34.67 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.038 0.447 . . . . 0.0 110.888 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.753 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -125.74 106.9 10.04 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.391 -179.365 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.51 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.61 123.64 38.17 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.324 0.583 . . . . 0.0 110.605 -177.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.473 HD23 ' HB2' ' A' 3656 ' ' HIS . 39.5 mt -126.42 145.05 51.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 114.706 -1.133 . . . . 0.0 109.912 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3580 ' ' PRO . . . . . 0.435 ' HA ' ' O ' ' A' 3521 ' ' ALA . 17.8 Cg_endo -60.23 111.38 0.99 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 122.323 2.016 . . . . 0.0 112.079 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.1 p -96.5 113.22 24.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.16 0.505 . . . . 0.0 109.975 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3582 ' ' GLY . . . . . 0.453 ' HA3' HG22 ' A' 3588 ' ' VAL . . . -96.36 146.15 18.13 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.111 -175.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -73.31 -15.48 61.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.935 0.874 . . . . 0.0 109.417 177.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.643 ' O ' HG23 ' A' 3588 ' ' VAL . 16.7 t70 -158.35 167.03 30.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.113 -1.403 . . . . 0.0 107.22 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -58.62 -40.9 84.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 118.144 0.429 . . . . 0.0 110.47 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.51 -37.23 86.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.513 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.533 ' HB3' ' H ' ' A' 3584 ' ' ASP . 17.1 t70 -63.45 -44.26 95.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.769 178.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' 3584 ' ' ASP . 58.1 t -54.1 -42.52 55.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.727 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 5.4 t -62.75 -49.27 84.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.629 0.728 . . . . 0.0 109.571 -178.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 55.8 m -62.74 -39.9 95.53 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.765 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3591 ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' 3587 ' ' ASP . 24.6 mm-40 -70.56 -39.48 73.92 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.358 -0.214 . . . . 0.0 110.972 179.075 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 73.8 m -60.14 -50.32 74.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.842 0.353 . . . . 0.0 111.157 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.537 ' HA ' ' HG2' ' A' 3596 ' ' LYS . 11.4 pt-20 -66.76 -30.89 71.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.166 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 50.5 m -70.54 -40.47 73.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.089 0.471 . . . . 0.0 110.219 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.522 HD12 ' HB2' ' A' 3599 ' ' PHE . 59.5 tp -65.61 -46.16 80.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.09 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.793 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 19.9 ptmt -65.65 -34.39 78.11 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.256 -178.09 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -78.17 -39.19 41.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.671 0.272 . . . . 0.0 111.393 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.49 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -91.05 -46.26 8.23 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -172.066 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.522 ' HB2' HD12 ' A' 3595 ' ' LEU . 19.1 m-85 -99.01 -50.37 4.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.774 0.321 . . . . 0.0 111.533 -174.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.793 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 23.2 mm -61.91 -58.13 8.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.067 -175.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 87.7 m -57.55 -42.54 83.19 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.147 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.797 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -62.43 -57.37 11.5 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 121.366 -0.133 . . . . 0.0 110.979 178.325 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.797 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.1 OUTLIER -57.13 -39.2 74.69 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.58 0.229 . . . . 0.0 111.466 -176.322 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -77.53 -38.13 49.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.748 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.74 -35.56 75.08 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.966 0.413 . . . . 0.0 111.129 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3606 ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' 3602 ' ' TYR . 27.1 mmmt -87.71 -9.09 55.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.931 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 47.33 63.45 1.97 Allowed 'General case' 0 C--O 1.235 0.328 0 O-C-N 123.764 0.665 . . . . 0.0 111.266 -177.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.561 ' O ' HD12 ' A' 3603 ' ' LEU . . . -143.23 -177.42 5.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.009 -0.541 . . . . 0.0 112.027 -175.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.739 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -116.04 118.25 32.37 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.164 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3610 ' ' GLY . . . . . 0.445 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.07 102.73 0.55 Allowed Glycine 0 C--O 1.223 -0.547 0 C-N-CA 120.718 -0.753 . . . . 0.0 111.343 178.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.678 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.6 mm -89.55 123.84 41.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.238 0.542 . . . . 0.0 110.795 -175.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.647 HD13 ' HB3' ' A' 3547 ' ' LEU . 53.8 mt -119.23 106.79 19.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.739 175.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.45 ' HA ' ' O ' ' A' 3624 ' ' TYR . 69.7 m-20 -82.97 106.85 15.14 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 175.206 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.513 HG21 ' HD3' ' A' 3539 ' ' PRO . 9.3 p . . . . . 0 C--N 1.312 -1.058 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.143 -171.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.45 ' O ' ' HA ' ' A' 3613 ' ' ASN . 79.0 m-85 . . . . . 0 C--O 1.236 0.363 0 CA-C-O 121.061 0.458 . . . . 0.0 110.52 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.455 HG13 HD12 ' A' 3611 ' ' ILE . 15.5 t -113.39 114.28 46.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.972 176.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.626 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.4 mp -100.41 113.44 26.2 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.483 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 14.3 mt-30 -94.68 110.38 22.22 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.647 -178.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.589 HG12 HG12 ' A' 3659 ' ' ILE . 40.5 mt -91.82 98.19 8.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.072 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -88.58 141.71 30.49 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.297 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.649 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 57.2 Cg_endo -71.31 164.6 35.2 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.572 2.182 . . . . 0.0 111.504 176.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.26 85.86 0.33 Allowed 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.799 2.333 . . . . 0.0 112.016 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3632 ' ' CYS . . . . . 0.55 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.1 p -112.4 162.12 15.92 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.002 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -55.74 -33.78 64.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.684 0.278 . . . . 0.0 110.305 179.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.97 -42.58 80.65 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.084 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3635 ' ' SER . . . . . 0.464 ' O ' ' HG ' ' A' 3639 ' ' LEU . 58.7 p -65.32 -52.55 53.22 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.105 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3636 ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' A' 3632 ' ' CYS . 5.6 mm-40 -63.68 -35.53 80.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.402 -175.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 14.3 p -64.56 -54.69 28.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.606 -176.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -71.34 -19.47 62.29 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 118.871 -1.132 . . . . 0.0 110.733 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3639 ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' 3635 ' ' SER . 41.9 mt -64.9 -35.84 82.44 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.23 172.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.534 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 18.1 m -70.31 -31.83 69.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.423 0.63 . . . . 0.0 109.941 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -76.06 -43.92 41.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.849 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.778 HD13 HD22 ' A' 3575 ' ' LEU . 17.9 mt -85.21 -38.96 18.34 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.512 -0.767 . . . . 0.0 112.753 -172.129 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -147.85 82.92 7.66 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.899 0.381 . . . . 0.0 111.556 -177.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.59 -28.06 21.74 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.069 2.513 . . . . 0.0 113.882 -174.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 4.2 t0 -77.73 -37.93 48.19 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.33 -172.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.753 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -80.03 -31.17 39.57 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 175.184 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.534 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.04 -43.69 70.39 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.452 177.189 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -62.05 -25.76 67.87 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.382 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 73.3 m -78.92 -40.23 32.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.026 0.441 . . . . 0.0 110.598 176.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.861 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.8 pt -82.79 -18.32 10.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.818 -172.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.9 t -59.08 -25.69 63.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -88.84 -35.0 16.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.919 0.39 . . . . 0.0 110.617 174.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.861 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.4 OUTLIER -98.84 30.97 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 122.81 1.291 . . . . 0.0 109.083 -175.56 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.427 ' N ' ' HD2' ' A' 3655 ' ' PRO . 18.7 m -30.03 -42.88 0.2 Allowed Pre-proline 0 CA--C 1.542 0.657 0 CA-C-N 113.763 -1.562 . . . . 0.0 114.851 173.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.431 ' HG2' HD13 ' A' 3653 ' ' ILE . 15.9 Cg_endo -60.55 65.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.849 1.699 . . . . 0.0 112.345 168.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3656 ' ' HIS . . . . . 0.473 ' HB2' HD23 ' A' 3579 ' ' LEU . 23.6 p80 -136.37 174.15 10.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.866 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.525 HD22 HG22 ' A' 3628 ' ' ILE . 31.6 mt -119.93 149.12 42.63 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.765 0.317 . . . . 0.0 110.853 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 51.8 ttp -112.88 110.94 21.35 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.861 HD12 HD21 ' A' 3524 ' ' LEU . 71.0 mt -105.63 118.35 52.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.153 0.501 . . . . 0.0 111.42 -172.125 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.667 HG13 ' HD2' ' A' 3573 ' ' TYR . 77.2 t -103.18 116.76 47.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.805 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.626 HG12 ' HG ' ' A' 3626 ' ' LEU . 59.1 mt -90.95 114.98 29.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.11 127.94 56.35 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.852 0.358 . . . . 0.0 111.443 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 8.5 m -70.1 137.94 51.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.831 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.518 179.154 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.491 ' CD1' ' HB2' ' A' 3553 ' ' MET . 38.1 m-85 . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' A' 3551 ' ' GLN . 1.3 tp10 55.29 -160.81 0.17 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.139 0.495 . . . . 0.0 110.897 175.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 7.7 p -144.2 129.9 19.19 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 167.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.575 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.454 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.526 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp . . . . . 0 N--CA 1.458 -0.073 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.709 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -73.12 -15.53 61.48 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.098 -0.641 . . . . 0.0 110.477 -174.202 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.59 ' N ' HD13 ' A' 3502 ' ' LEU . 55.5 tptt -68.13 -28.33 67.22 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 175.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.452 ' HB3' ' CE2' ' A' 3505 ' ' TYR . 4.3 mmmm -92.26 -42.96 9.55 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.776 175.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.729 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -153.5 108.6 2.57 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.812 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3506 ' ' PRO . . . . . 0.709 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 94.0 Cg_endo -87.49 173.55 5.38 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 124.127 3.218 . . . . 0.0 114.025 -175.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.429 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.3 mt -72.11 132.71 33.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.61 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.462 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.0 m -103.4 -31.15 2.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.596 -177.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.722 ' HB2' HD13 ' A' 3538 ' ' LEU . 47.3 t90 -147.56 153.64 39.7 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -175.514 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3510 ' ' GLN . . . . . 0.476 ' HG3' ' HB3' ' A' 3523 ' ' GLN . 21.7 tt0 -151.25 120.01 6.57 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -176.13 -123.29 0.76 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.676 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.5 mp -141.04 157.12 45.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.059 0.457 . . . . 0.0 111.059 179.156 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.444 ' HG ' HG21 ' A' 3522 ' ' VAL . 92.3 mt -108.91 151.29 26.48 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 168.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.739 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -147.65 126.92 13.02 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.74 0.305 . . . . 0.0 111.465 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.748 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.28 141.84 41.95 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 172.914 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.748 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.6 OUTLIER 63.6 -92.12 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -169.446 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 11.5 m120 -147.22 15.1 1.15 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 172.562 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.487 ' O ' ' HA ' ' A' 3514 ' ' ALA . 4.9 m-20 -96.02 123.26 39.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.361 -176.192 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.494 HG22 ' HB2' ' A' 3514 ' ' ALA . 37.0 p -113.75 138.77 49.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.074 0.464 . . . . 0.0 111.63 -177.72 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.97 116.11 14.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.473 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.644 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.73 122.94 20.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.97 0.414 . . . . 0.0 110.333 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.444 HG21 ' HG ' ' A' 3513 ' ' LEU . 35.2 m -132.43 149.03 31.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.915 -175.366 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3523 ' ' GLN . . . . . 0.476 ' HB3' ' HG3' ' A' 3510 ' ' GLN . 17.4 pt20 -112.45 127.59 56.08 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 170.006 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.887 HD21 HD12 ' A' 3659 ' ' ILE . 1.2 mt -95.35 113.3 24.95 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.039 -174.601 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.429 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 80.2 m-70 -88.0 136.31 33.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.714 175.251 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.729 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.1 t80 -67.67 139.55 56.78 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 174.136 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.572 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.5 t -115.1 -58.11 3.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 121.387 0.613 . . . . 0.0 110.979 176.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.44 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 65.0 m -159.69 171.91 18.7 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.275 -171.569 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.36 -152.02 23.11 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.632 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.59 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.6 t-20 -100.24 112.89 25.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.843 0.354 . . . . 0.0 110.608 -178.223 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -64.67 -32.08 73.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.495 -176.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 39.9 t -59.47 -32.37 48.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.42 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.46 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 20.3 mt -58.42 -45.81 87.69 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.775 176.12 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -66.6 -40.84 89.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.112 0.482 . . . . 0.0 110.076 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 14.7 t60 -57.57 -41.73 81.68 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.707 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -89.19 -14.32 36.32 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -176.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.451 ' O ' HG21 ' A' 3614 ' ' VAL . 42.4 p -96.81 -39.25 9.52 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 121.981 -0.449 . . . . 0.0 111.617 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.722 HD13 ' HB2' ' A' 3509 ' ' TRP . 31.1 mt -80.43 108.65 10.21 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-O 120.926 0.393 . . . . 0.0 109.978 -175.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo . . . . . 0 N--CA 1.459 -0.547 0 C-N-CA 122.854 2.369 . . . . 0.0 113.06 -171.902 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A 3546 ' ' PRO . . . . . 0.676 ' HA ' ' O ' ' A' 3512 ' ' LEU . 34.8 Cg_endo . . . . . 0 CA--C 1.529 0.266 0 N-CA-C 113.439 0.515 . . . . 0.0 113.439 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.688 ' HB3' HD13 ' A' 3612 ' ' ILE . 29.1 mt -69.24 124.18 23.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.84 173.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.739 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -105.05 142.49 34.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.782 0.325 . . . . 0.0 111.773 -173.903 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.557 HG22 HD12 ' B' 2521 ' ' LEU . 34.9 mt -98.89 107.03 19.76 Favored 'Isoleucine or valine' 0 C--O 1.254 1.298 0 CA-C-O 122.608 1.194 . . . . 0.0 112.069 -172.628 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -107.34 -9.04 16.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.614 -1.175 . . . . 0.0 111.949 -173.463 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.657 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 58.8 mt-30 -146.29 175.2 10.7 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.951 -0.113 . . . . 0.0 110.859 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.686 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.32 137.0 13.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.87 0.367 . . . . 0.0 111.353 -179.558 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.64 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 13.6 tmm? -108.17 113.79 27.19 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.174 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3554 ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' 3556 ' ' GLU . 14.1 mmt180 -62.52 110.34 1.66 Allowed 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 175.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.494 ' O ' HD12 ' A' 3555 ' ' LEU . 2.3 pp -68.29 97.96 0.78 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.304 1.05 . . . . 0.0 109.809 -173.634 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.622 ' O ' ' HG ' ' A' 3560 ' ' LEU . 41.5 mt-10 -95.34 154.41 17.21 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.256 -1.338 . . . . 0.0 109.482 -178.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.612 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.49 -42.68 74.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.22 0.534 . . . . 0.0 109.725 174.047 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 19.3 m -63.26 -41.5 99.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.945 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.585 ' O ' HG23 ' A' 3563 ' ' VAL . 27.7 mm-40 -62.97 -48.34 79.29 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.435 177.262 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' 3556 ' ' GLU . 69.5 mt -59.02 -35.87 74.0 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.288 0.367 . . . . 0.0 110.873 -178.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.9 mm-40 -57.97 -51.72 68.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.428 0.632 . . . . 0.0 110.497 174.13 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -63.95 -40.1 97.95 Favored Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.226 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.664 ' O ' ' HG3' ' A' 3567 ' ' MET . 73.2 t -59.62 -48.18 88.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 176.23 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -53.67 -42.7 68.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.196 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.569 ' O ' ' HB ' ' A' 3568 ' ' THR . 96.4 mtt180 -60.42 -44.46 95.74 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.851 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -76.55 -15.3 59.9 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.087 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.664 ' HG3' ' O ' ' A' 3563 ' ' VAL . 88.0 mtp -83.74 -19.19 35.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.687 0.756 . . . . 0.0 109.126 173.016 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3568 ' ' THR . . . . . 0.569 ' HB ' ' O ' ' A' 3565 ' ' ARG . 56.2 m -77.06 -21.59 54.23 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.009 176.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 60.5 t -116.45 84.51 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.9 177.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.0 108.13 3.4 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.59 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 1.9 m 157.88 -42.99 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.249 1.42 . . . . 0.0 108.02 -173.232 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -84.8 -17.36 38.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.025 -177.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.724 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -138.17 163.9 30.54 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 120.979 0.419 . . . . 0.0 109.994 177.401 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.631 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 29.3 t -126.12 135.64 51.94 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 172.117 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.746 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.97 125.54 51.11 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.603 HD11 HD11 ' A' 3661 ' ' ILE . 82.2 mt -126.72 154.89 43.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.11 0.481 . . . . 0.0 110.837 -177.364 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.608 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.83 108.02 13.43 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.611 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.488 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.68 122.42 37.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.299 0.571 . . . . 0.0 110.495 -177.537 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.457 ' HG ' HD12 ' A' 3577 ' ' LEU . 83.4 mt -126.75 142.01 42.08 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.688 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3580 ' ' PRO . . . . . 0.495 ' HA ' ' O ' ' A' 3521 ' ' ALA . 20.5 Cg_endo -60.46 117.3 4.05 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 122.67 2.247 . . . . 0.0 112.091 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.4 p -101.58 107.8 19.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.272 0.558 . . . . 0.0 111.003 -177.074 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.71 146.18 16.34 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.604 -179.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 5.2 ttp85 -64.72 -35.29 80.57 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.596 0.712 . . . . 0.0 110.064 176.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.598 ' O ' HG23 ' A' 3588 ' ' VAL . 15.1 t70 -134.92 164.37 27.75 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -55.42 -38.38 68.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 117.994 0.361 . . . . 0.0 110.392 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -62.2 -44.64 96.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.507 176.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.456 ' HB3' ' H ' ' A' 3584 ' ' ASP . 24.4 t0 -63.71 -40.87 97.84 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.013 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' 3584 ' ' ASP . 91.4 t -57.04 -48.55 81.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.043 176.525 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 65.5 t -57.36 -48.73 82.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.348 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 48.0 t -54.86 -53.34 56.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.097 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -66.25 -36.11 82.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.387 -177.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 78.7 m -60.73 -50.94 71.47 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 176.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.524 ' HA ' ' HD3' ' A' 3596 ' ' LYS . 39.5 tp10 -61.3 -44.45 97.19 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.005 -178.607 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 37.5 m -61.36 -45.34 94.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.69 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.559 HD12 ' HB2' ' A' 3599 ' ' PHE . 59.5 tp -60.85 -42.77 98.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.429 178.153 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.568 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 50.2 mtpt -55.78 -54.16 47.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.853 177.316 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.79 -40.67 88.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.274 -176.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -89.93 -46.86 8.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -169.48 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.559 ' HB2' HD12 ' A' 3595 ' ' LEU . 22.3 m-85 -99.56 -50.43 4.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.753 0.311 . . . . 0.0 111.515 -175.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.568 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.0 mm -61.32 -54.39 35.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.717 -176.116 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 45.8 m -59.89 -41.12 90.89 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.267 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.702 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -65.98 -57.03 8.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.906 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.702 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.3 OUTLIER -56.8 -43.61 81.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -177.578 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -69.63 -35.83 75.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.491 -176.739 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -67.86 -38.89 83.68 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.105 0.478 . . . . 0.0 110.659 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -78.81 -18.04 54.73 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.627 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 49.67 53.7 12.28 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -169.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.521 ' O ' HD12 ' A' 3603 ' ' LEU . . . -133.94 -175.89 3.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.044 -170.105 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.686 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.38 118.32 30.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.411 175.324 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3610 ' ' GLY . . . . . 0.493 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.77 104.03 0.79 Allowed Glycine 0 C--O 1.221 -0.707 0 C-N-CA 120.718 -0.753 . . . . 0.0 111.292 177.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.657 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 38.9 mm -90.12 122.45 41.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 121.333 0.587 . . . . 0.0 111.439 -173.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.688 HD13 ' HB3' ' A' 3547 ' ' LEU . 51.1 mt -119.71 111.56 33.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.221 176.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.4 m-20 -87.46 125.59 34.39 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.451 HG21 ' O ' ' A' 3537 ' ' SER . 5.3 p . . . . . 0 C--N 1.315 -0.919 0 CA-C-O 121.02 0.438 . . . . 0.0 111.262 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.517 ' O ' ' HA ' ' A' 3613 ' ' ASN . 86.4 m-85 . . . . . 0 CA--C 1.506 -0.74 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.477 HG12 ' HG3' ' A' 3627 ' ' GLN . 4.1 t -122.23 113.16 37.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.902 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.66 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -94.46 111.34 23.09 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 170.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.487 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 63.0 mt-30 -94.4 110.66 22.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.76 -177.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.607 HG12 HG12 ' A' 3659 ' ' ILE . 32.8 mt -90.87 97.84 7.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.086 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -86.29 141.2 34.63 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.984 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.655 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 60.7 Cg_endo -72.92 169.69 21.52 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.486 2.124 . . . . 0.0 111.361 176.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.03 77.63 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.441 2.094 . . . . 0.0 111.64 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3632 ' ' CYS . . . . . 0.537 ' O ' ' HG2' ' A' 3636 ' ' GLU . 10.4 p -112.88 162.64 15.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.044 -174.46 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -45.99 -39.75 9.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.469 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 46.6 t80 -61.52 -52.98 62.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.495 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 56.4 p -66.37 -54.77 20.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.927 -175.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3636 ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' 3632 ' ' CYS . 5.3 mm-40 -59.39 -38.56 80.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.268 -173.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 39.0 t -66.33 -50.11 64.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.752 0.311 . . . . 0.0 110.667 -178.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 61.8 m80 -65.81 -31.81 72.99 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.42 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.92 -30.98 72.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.956 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.763 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 20.1 m -74.84 -31.46 61.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.323 0.582 . . . . 0.0 109.89 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -79.61 -47.2 15.86 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.932 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.746 HD13 HD22 ' A' 3575 ' ' LEU . 14.7 mt -79.36 -41.8 27.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.139 -173.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -138.2 72.08 46.28 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -174.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -64.71 -19.29 64.47 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.207 1.938 . . . . 0.0 112.014 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3645 ' ' ASP . . . . . 0.473 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 6.6 m-20 -67.84 -60.78 2.25 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.559 -178.432 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.608 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -77.15 -26.42 53.03 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.635 -178.27 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.763 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.18 -44.12 71.27 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.231 177.01 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.99 -18.07 63.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.47 -178.122 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 17.9 m -89.62 -36.76 15.1 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.052 0.453 . . . . 0.0 110.545 177.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.777 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.2 pt -83.11 -10.5 11.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.785 -174.268 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.4 p -60.06 -25.18 65.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.958 0.408 . . . . 0.0 110.402 176.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -83.93 -41.87 16.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.313 0.577 . . . . 0.0 110.011 173.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.777 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.3 OUTLIER -99.57 34.21 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-O 123.184 1.469 . . . . 0.0 109.094 -172.366 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.45 ' N ' ' HD2' ' A' 3655 ' ' PRO . 23.2 m -34.67 -43.99 0.59 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 113.529 -1.669 . . . . 0.0 114.489 173.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' 3654 ' ' SER . 15.8 Cg_endo -60.19 86.05 0.07 OUTLIER 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.656 1.571 . . . . 0.0 111.821 170.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 3.8 p-80 -152.12 178.29 9.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.488 -176.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.501 ' HB3' HG23 ' A' 3628 ' ' ILE . 42.2 mt -126.9 133.62 50.63 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.474 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 60.1 ttp -97.32 109.99 22.63 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.887 HD12 HD21 ' A' 3524 ' ' LEU . 92.3 mt -100.59 116.74 44.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.28 0.562 . . . . 0.0 111.459 -173.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.724 HG13 ' HD2' ' A' 3573 ' ' TYR . 93.2 t -102.84 113.0 38.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.97 -178.443 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.66 HG12 ' HG ' ' A' 3626 ' ' LEU . 53.6 mt -90.78 113.13 26.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.294 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.62 127.98 55.91 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.687 0.279 . . . . 0.0 111.07 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 11.7 p -95.85 110.94 23.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.056 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 C--O 1.248 0.98 0 CA-C-O 119.409 -0.329 . . . . 0.0 111.074 -178.808 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.571 ' CD1' ' HB2' ' A' 3553 ' ' MET . 20.3 m-85 . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.577 ' CG ' ' H ' ' B' 2520 ' ' THR . 8.6 tt0 55.98 -158.24 0.23 Allowed 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 175.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.577 ' H ' ' CG ' ' B' 2519 ' ' GLU . 88.9 m -151.78 123.65 8.03 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 174.432 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.624 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.517 -0.315 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -178.328 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.613 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.7 pp . . . . . 0 N--CA 1.455 -0.194 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.64 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -71.31 -15.76 62.42 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.192 -173.31 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.64 ' N ' HD13 ' A' 3502 ' ' LEU . 23.5 tptm -69.59 -27.06 64.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.273 177.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.713 ' HD3' ' CE2' ' A' 3505 ' ' TYR . 32.5 tttt -100.37 -42.02 6.8 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.475 179.437 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.713 ' CE2' ' HD3' ' A' 3504 ' ' LYS . 0.1 OUTLIER -146.71 106.9 4.02 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.308 177.038 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -86.52 174.01 6.09 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 124.27 3.313 . . . . 0.0 113.886 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.559 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 95.2 mt -72.05 138.79 20.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.118 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.439 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.7 m -105.94 -28.17 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.785 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.649 ' HB2' HD13 ' A' 3538 ' ' LEU . 21.1 t90 -153.54 154.75 34.89 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -176.549 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -151.14 121.4 7.27 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.117 0.484 . . . . 0.0 110.126 178.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -171.75 -123.94 0.73 Allowed Glycine 0 N--CA 1.441 -0.997 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.662 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.1 mp -141.34 158.76 43.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.1 0.476 . . . . 0.0 111.094 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.452 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.5 mt -112.79 151.46 30.32 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 168.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.668 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.75 125.93 14.66 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.729 0.3 . . . . 0.0 111.575 -178.359 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.788 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.02 142.59 38.25 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 173.119 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.788 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 59.88 -94.93 0.05 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.119 0.485 . . . . 0.0 110.157 -171.268 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -136.47 4.78 2.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.192 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.429 ' O ' ' HA ' ' A' 3514 ' ' ALA . 47.8 m-20 -102.53 138.54 39.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.333 -172.79 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.537 HG22 ' HB2' ' A' 3514 ' ' ALA . 27.8 p -127.02 138.04 53.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.943 -179.269 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -133.83 119.97 19.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.08 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.662 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -71.92 120.19 17.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.049 0.452 . . . . 0.0 110.52 178.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.433 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 33.7 m -132.06 147.76 32.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.857 -175.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -110.95 129.9 55.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.838 172.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.886 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -98.09 110.67 23.21 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.356 0.598 . . . . 0.0 111.886 -175.51 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.559 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 54.8 m-70 -84.99 137.11 33.28 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.56 175.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.707 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.7 t80 -67.08 136.38 55.1 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 173.772 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.563 ' CG1' HD23 ' A' 3575 ' ' LEU . 18.8 t -115.11 -55.89 4.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.42 0.629 . . . . 0.0 110.798 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.415 ' OG ' HD22 ' A' 3642 ' ' LEU . 48.0 t -159.04 171.72 19.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.708 -172.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.42 -150.22 21.14 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.766 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.7 t-20 -104.87 110.33 22.65 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -61.64 -29.6 70.17 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.544 -176.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3532 ' ' VAL . . . . . 0.538 ' HB ' ' OD1' ' A' 3530 ' ' ASN . 60.9 t -60.55 -33.46 54.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.364 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.552 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 20.4 mt -57.37 -41.46 80.21 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.944 176.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.519 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.76 -45.62 77.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.847 0.356 . . . . 0.0 110.462 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -60.99 -33.88 73.93 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.187 -178.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.403 ' HD3' HD23 ' A' 3533 ' ' LEU . 15.5 ptm180 -90.01 -13.91 35.04 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -178.339 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.458 ' HB2' HD11 ' A' 3626 ' ' LEU . 66.5 p -101.87 -34.72 9.28 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 122.014 -0.429 . . . . 0.0 111.317 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.649 HD13 ' HB2' ' A' 3509 ' ' TRP . 26.9 mt -80.44 114.08 44.57 Favored Pre-proline 0 C--N 1.319 -0.72 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -177.175 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo . . . . . 0 N--CA 1.455 -0.736 0 C-N-CA 123.073 2.515 . . . . 0.0 113.431 -169.975 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A 3546 ' ' PRO . . . . . 0.603 ' HA ' ' O ' ' A' 3512 ' ' LEU . 37.1 Cg_endo . . . . . 0 N--CA 1.461 -0.397 0 N-CA-C 112.801 0.27 . . . . 0.0 112.801 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.729 ' HB3' HD13 ' A' 3612 ' ' ILE . 37.9 mt -68.82 118.09 11.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.4 178.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.668 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.1 OUTLIER -94.24 133.75 37.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.199 0.523 . . . . 0.0 111.439 -178.116 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.63 HG22 HD12 ' B' 2521 ' ' LEU . 23.1 mt -84.49 108.05 16.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-O 122.185 0.993 . . . . 0.0 110.75 -177.252 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -105.01 -12.31 16.23 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.594 -1.184 . . . . 0.0 111.733 -171.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.652 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 87.5 mt-30 -150.36 177.55 9.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.54 -177.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.724 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.32 141.7 19.64 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 120.693 0.282 . . . . 0.0 111.411 179.495 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.629 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.5 tmm? -109.75 109.03 19.6 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 175.144 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3554 ' ' ARG . . . . . 0.445 ' O ' ' HG3' ' A' 3556 ' ' GLU . 49.1 mtt180 -58.97 110.97 1.14 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' 3555 ' ' LEU . 2.3 pp -68.39 99.18 0.91 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 122.304 1.049 . . . . 0.0 110.56 -173.538 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.523 ' O ' ' HG ' ' A' 3560 ' ' LEU . 33.9 mt-10 -103.04 157.76 16.77 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.081 176.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.508 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.91 -50.53 70.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.622 0.249 . . . . 0.0 110.908 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 25.6 p -62.19 -39.66 93.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.988 0.423 . . . . 0.0 111.255 178.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.519 ' O ' HG23 ' A' 3563 ' ' VAL . 57.5 mm-40 -65.97 -41.13 91.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.563 -178.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.54 HD21 ' HB2' ' A' 3555 ' ' LEU . 83.7 mt -64.24 -34.78 78.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.779 0.323 . . . . 0.0 110.809 -179.261 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' 3557 ' ' ALA . 12.1 mm-40 -68.66 -41.66 79.0 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 174.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -57.8 -41.51 94.04 Favored Glycine 0 CA--C 1.517 0.164 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.796 175.163 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.561 ' O ' ' HG3' ' A' 3567 ' ' MET . 95.5 t -61.7 -51.38 73.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 174.327 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3564 ' ' ALA . . . . . 0.515 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.63 -24.05 63.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.903 -178.56 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -61.15 -40.02 92.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.88 0.371 . . . . 0.0 110.536 -179.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3566 ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' 3566 ' ' ARG . 9.9 ptp180 -87.99 -14.69 38.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.998 0.427 . . . . 0.0 110.569 176.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.561 ' HG3' ' O ' ' A' 3563 ' ' VAL . 84.9 mtp -74.68 -19.9 60.08 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.188 -178.029 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 14.7 t -89.01 3.29 52.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.112 0.482 . . . . 0.0 110.078 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 28.1 t -125.99 91.27 1.75 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.52 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -67.56 110.23 3.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.349 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.557 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 144.19 -38.98 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.561 1.544 . . . . 0.0 108.583 -177.481 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -82.19 -20.65 37.39 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.782 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.747 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -144.38 165.55 27.59 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.195 176.876 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.608 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 37.2 t -127.8 135.99 50.85 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 170.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.792 HD22 HD13 ' A' 3642 ' ' LEU . 14.7 tp -106.46 125.45 51.01 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.59 HD11 HD11 ' A' 3661 ' ' ILE . 78.7 mt -126.57 153.44 45.23 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.203 0.525 . . . . 0.0 110.558 -178.367 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.621 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.0 108.12 13.92 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.974 -0.751 . . . . 0.0 108.974 -179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.485 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 121.18 35.67 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.363 0.601 . . . . 0.0 110.449 -177.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.43 ' HG ' HD12 ' A' 3577 ' ' LEU . 68.2 mt -121.04 144.11 38.55 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 114.744 -1.117 . . . . 0.0 110.142 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.09 109.9 0.91 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.215 1.944 . . . . 0.0 111.705 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 18.2 p -95.96 115.72 27.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.208 0.528 . . . . 0.0 110.2 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3582 ' ' GLY . . . . . 0.442 ' HA3' HG22 ' A' 3588 ' ' VAL . . . -102.38 145.87 16.66 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.432 -0.889 . . . . 0.0 112.963 -176.041 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -19.35 63.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.827 0.822 . . . . 0.0 109.689 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.66 ' O ' HG23 ' A' 3588 ' ' VAL . 31.7 t70 -156.97 164.41 38.05 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -57.17 -35.57 69.71 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.021 0.439 . . . . 0.0 110.351 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.53 -41.52 79.8 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.778 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.541 ' HB3' ' H ' ' A' 3584 ' ' ASP . 13.9 t70 -61.94 -40.53 95.87 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.362 177.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' 3584 ' ' ASP . 58.6 t -57.18 -45.04 84.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.271 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.325 178.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 7.1 t -62.31 -53.66 44.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.472 0.653 . . . . 0.0 109.616 -178.054 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 53.6 m -54.55 -48.88 71.49 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.601 178.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -68.89 -34.28 75.15 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -179.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 87.0 m -61.06 -46.77 89.34 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.851 -0.339 . . . . 0.0 110.115 177.166 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -64.84 -45.08 87.6 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.979 179.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 70.4 m -53.52 -43.45 68.32 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.736 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.538 HD12 ' HB2' ' A' 3599 ' ' PHE . 53.4 tp -67.86 -44.09 77.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.719 177.516 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.593 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 49.6 mtpt -57.98 -57.99 10.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.894 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -63.01 -34.68 78.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.606 -177.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.84 -47.43 6.15 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -171.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.538 ' HB2' HD12 ' A' 3595 ' ' LEU . 17.2 m-85 -99.62 -50.75 3.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.736 0.303 . . . . 0.0 111.529 -174.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.4 mm -61.5 -50.88 78.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.424 -176.464 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 60.4 m -58.73 -50.01 75.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.518 178.219 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.675 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.2 OUTLIER -59.75 -58.67 7.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.561 -178.913 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.675 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.4 OUTLIER -54.59 -41.35 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -176.679 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -79.28 -37.37 37.97 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.707 -176.224 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.29 -39.73 81.99 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.007 0.432 . . . . 0.0 111.185 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3606 ' ' LYS . . . . . 0.448 ' HG3' ' CD1' ' A' 3602 ' ' TYR . 21.6 mmmt -81.51 -15.79 53.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.928 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 52.79 65.42 1.52 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.338 -173.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.623 ' O ' HD12 ' A' 3603 ' ' LEU . . . -146.15 -174.6 4.48 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.916 0.388 . . . . 0.0 111.801 -175.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.724 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -121.81 118.75 29.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.65 177.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3610 ' ' GLY . . . . . 0.533 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.98 103.15 0.66 Allowed Glycine 0 C--O 1.221 -0.661 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.833 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.652 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 39.7 mm -89.38 120.9 38.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 121.312 0.577 . . . . 0.0 111.092 -174.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.729 HD13 ' HB3' ' A' 3547 ' ' LEU . 32.8 mt -120.52 107.43 20.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.862 176.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.449 ' HA ' ' O ' ' A' 3624 ' ' TYR . 48.9 m-80 -82.54 127.0 32.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.868 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 35.0 m . . . . . 0 C--N 1.321 -0.668 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.618 179.495 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.449 ' O ' ' HA ' ' A' 3613 ' ' ASN . 72.0 m-85 . . . . . 0 CA--C 1.513 -0.48 0 CA-C-O 120.972 0.415 . . . . 0.0 110.419 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.421 HG13 HD12 ' A' 3611 ' ' ILE . 4.5 t -120.5 116.01 48.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.234 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -97.57 111.71 23.87 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 169.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.426 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 39.1 mt-30 -94.76 111.29 23.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.067 -177.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.603 HG12 HG12 ' A' 3659 ' ' ILE . 45.2 mt -89.61 98.91 8.63 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.294 178.483 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -88.34 139.5 30.18 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.996 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.547 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 47.5 Cg_endo -68.56 172.95 10.59 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.73 2.287 . . . . 0.0 111.765 178.029 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.03 37.45 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.778 2.318 . . . . 0.0 112.359 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3632 ' ' CYS . . . . . 0.431 ' H ' ' C ' ' A' 3630 ' ' PRO . 24.4 p -77.71 163.47 26.14 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.908 -178.873 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -44.67 -40.94 6.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.288 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3634 ' ' PHE . . . . . 0.443 ' HB2' HD13 ' A' 3560 ' ' LEU . 51.2 t80 -52.67 -51.53 59.83 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 34.4 p -70.08 -54.22 14.03 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.126 -173.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -58.81 -37.66 76.87 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -176.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 15.0 t -62.82 -50.71 69.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.094 0.473 . . . . 0.0 110.341 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 57.6 m80 -67.71 -32.72 73.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.647 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3639 ' ' LEU . . . . . 0.435 ' HB3' HD23 ' A' 3647 ' ' LEU . 79.1 mt -63.94 -39.51 94.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.726 176.327 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3640 ' ' SER . . . . . . . . . . . . . 46.6 m -67.21 -26.76 66.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.265 0.555 . . . . 0.0 110.298 178.093 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 24.9 ttm180 -80.42 -47.52 14.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.759 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.792 HD13 HD22 ' A' 3575 ' ' LEU . 9.9 mt -86.9 -31.82 20.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.908 -170.553 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.419 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -150.45 73.24 9.07 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -174.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.24 -16.4 48.37 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.723 2.282 . . . . 0.0 111.958 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3645 ' ' ASP . . . . . 0.598 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 3.9 m-20 -71.92 -55.03 8.22 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.083 -178.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.621 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.5 -30.19 47.03 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.889 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.502 ' HA ' ' CG1' ' A' 3650 ' ' ILE . 3.3 tm? -54.5 -43.2 71.61 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.909 0.385 . . . . 0.0 110.235 177.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.25 -21.69 66.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.511 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 14.7 t -90.1 -31.12 17.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.89 0.376 . . . . 0.0 110.728 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.615 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.0 pt -84.72 -11.4 11.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.768 -175.736 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 10.7 p -62.78 -20.5 65.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.025 0.441 . . . . 0.0 110.521 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -85.51 -38.05 18.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.254 0.549 . . . . 0.0 109.94 173.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.615 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.1 tp -105.22 41.17 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 122.322 1.058 . . . . 0.0 109.446 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.466 ' N ' ' HD2' ' A' 3655 ' ' PRO . 64.5 m -36.71 -44.51 1.17 Allowed Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 114.26 -1.336 . . . . 0.0 113.837 172.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' 3654 ' ' SER . 12.8 Cg_endo -58.73 88.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.491 1.46 . . . . 0.0 111.744 169.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -157.16 177.67 11.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.343 -177.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.44 HD11 HD11 ' A' 3595 ' ' LEU . 36.3 mt -127.96 139.67 52.44 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.81 -178.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 55.6 ttp -102.48 109.27 20.85 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.886 HD12 HD21 ' A' 3524 ' ' LEU . 79.4 mt -101.21 116.29 44.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-O 121.291 0.567 . . . . 0.0 111.25 -173.163 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.747 HG13 ' HD2' ' A' 3573 ' ' TYR . 71.7 t -101.6 115.71 43.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.928 -177.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.625 HG12 ' HG ' ' A' 3626 ' ' LEU . 64.9 mt -90.84 112.7 25.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.374 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -114.31 127.7 55.99 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.898 0.38 . . . . 0.0 111.599 -177.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 53.0 m -84.42 135.12 34.4 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.008 171.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 5.9 p . . . . . 0 C--O 1.249 1.071 0 CA-C-O 119.008 -0.52 . . . . 0.0 109.67 176.155 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.629 ' CD1' ' HB2' ' A' 3553 ' ' MET . 38.3 m-85 . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 111.501 0.186 . . . . 0.0 111.501 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.577 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 4.9 mm-40 52.38 -152.14 0.26 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.551 0.691 . . . . 0.0 110.788 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 76.3 m -153.27 117.19 4.78 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 169.276 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.655 HD23 ' NH1' ' A' 3552 ' ' ARG . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.264 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.746 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.563 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.1 pp . . . . . 0 CA--C 1.53 0.19 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.643 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -69.09 -15.99 63.57 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 118.502 0.592 . . . . 0.0 110.872 -172.26 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.646 ' HE2' ' HA ' ' A' 3503 ' ' LYS . 7.7 mmpt? -78.51 -15.61 58.4 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.969 0.414 . . . . 0.0 109.921 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -101.02 -43.69 5.96 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 174.032 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.707 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.7 103.65 3.05 Favored Pre-proline 0 N--CA 1.443 -0.789 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.715 179.786 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -84.0 174.97 7.96 Favored 'Trans proline' 0 CA--C 1.531 0.373 0 C-N-CA 124.381 3.387 . . . . 0.0 113.705 -176.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.439 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 93.0 mt -70.63 139.41 20.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.044 179.241 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 27.4 m -107.17 -26.27 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.357 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.778 ' HE3' HD12 ' A' 3524 ' ' LEU . 61.2 t90 -153.87 145.41 23.21 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -142.42 120.02 11.78 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.98 -128.19 1.01 Allowed Glycine 0 N--CA 1.442 -0.942 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -178.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.624 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.0 mp -139.45 151.84 46.55 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.051 0.453 . . . . 0.0 110.901 179.304 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.47 HD23 ' HB2' ' A' 3547 ' ' LEU . 78.6 mt -105.74 146.03 30.35 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 168.578 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.661 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -141.47 123.39 15.37 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.755 -176.476 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.723 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.15 146.49 40.69 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 173.264 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.723 ' CD ' HD12 ' A' 3515 ' ' LEU . 1.1 mptm? 59.17 -92.91 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.179 0.592 . . . . 0.0 110.549 -171.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -142.08 4.98 1.68 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.187 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -103.02 135.73 44.17 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.384 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.523 HG22 ' HB2' ' A' 3514 ' ' ALA . 7.2 p -116.31 132.25 56.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.867 177.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -124.27 112.86 17.51 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.71 176.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.624 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.78 121.32 17.8 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.434 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -132.64 147.79 31.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.733 0.777 . . . . 0.0 111.911 -175.621 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -108.31 124.92 51.07 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.787 173.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.851 HD21 HD12 ' A' 3659 ' ' ILE . 1.4 mt -94.38 108.77 20.67 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.718 -175.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.439 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 83.7 m-70 -85.66 136.93 33.17 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.826 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.707 ' O ' ' HB2' ' A' 3505 ' ' TYR . 68.0 t80 -67.23 137.77 56.43 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.585 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.5 t -114.94 -56.43 4.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.53 0.681 . . . . 0.0 110.565 175.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 57.7 m -163.57 173.06 13.49 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.549 -171.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3529 ' ' GLY . . . . . 0.442 ' HA3' ' HA ' ' A' 3574 ' ' CYS . . . 90.78 -165.0 30.5 Favored Glycine 0 C--O 1.229 -0.2 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.253 177.452 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.569 ' HB2' ' HA ' ' A' 3571 ' ' THR . 49.2 t30 -92.72 108.48 20.02 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.618 0.247 . . . . 0.0 110.539 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 7.8 p30 -61.12 -25.02 66.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.405 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 59.2 t -62.5 -32.87 56.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.947 0.403 . . . . 0.0 110.422 178.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.459 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 24.9 mt -60.52 -39.39 87.62 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.603 177.142 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.475 ' HB1' HD12 ' A' 3538 ' ' LEU . . . -67.69 -40.95 84.32 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-O 120.72 0.295 . . . . 0.0 110.611 -178.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -59.59 -41.63 90.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.856 178.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -89.32 -7.74 54.73 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -174.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.566 ' HB2' HD11 ' A' 3626 ' ' LEU . 66.7 p -104.36 -41.6 5.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.086 0.47 . . . . 0.0 110.876 178.735 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.71 HD13 ' HB2' ' A' 3509 ' ' TRP . 25.7 mt -80.31 113.64 40.65 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.627 -178.045 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo . . . . . 0 N--CA 1.452 -0.931 0 C-N-CA 122.39 2.06 . . . . 0.0 112.415 -176.271 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 N--CA 1.459 -0.541 0 N-CA-C 111.613 -0.187 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.688 ' HB3' HD13 ' A' 3612 ' ' ILE . 36.0 mt -68.95 112.11 5.4 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.661 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -95.5 138.61 32.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.033 0.444 . . . . 0.0 110.792 -177.101 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.491 ' HA ' HG12 ' A' 3612 ' ' ILE . 17.9 mt -90.54 107.7 18.77 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 CA-C-O 122.155 0.979 . . . . 0.0 111.145 -174.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.422 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -106.99 -5.78 17.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.722 -1.126 . . . . 0.0 111.913 -172.792 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.664 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 85.0 mt-30 -150.92 175.65 11.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.654 0.264 . . . . 0.0 111.004 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.751 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -149.92 138.9 21.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.049 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.76 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 22.0 ttt -109.77 107.73 17.83 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.276 175.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 34.6 mtm180 -60.09 110.73 1.28 Allowed 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.804 0.335 . . . . 0.0 110.127 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.526 ' HB2' HD21 ' A' 3560 ' ' LEU . 1.8 pp -76.58 97.33 4.36 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.164 0.983 . . . . 0.0 109.863 -176.271 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.592 ' O ' ' HG ' ' A' 3560 ' ' LEU . 31.4 mt-10 -106.54 168.86 8.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.595 178.078 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.479 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.73 -50.57 68.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.724 0.297 . . . . 0.0 110.62 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 8.2 p -60.94 -40.89 94.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.389 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.583 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 77.8 mm-40 -66.31 -42.69 87.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.103 -177.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' 3556 ' ' GLU . 84.3 mt -60.39 -35.31 75.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.751 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' 3557 ' ' ALA . 15.0 mm-40 -59.89 -46.33 89.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.093 174.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -63.0 -38.76 97.14 Favored Glycine 0 N--CA 1.452 -0.247 0 CA-C-N 115.437 -0.802 . . . . 0.0 112.337 177.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.58 ' O ' ' HG3' ' A' 3567 ' ' MET . 62.1 t -62.02 -54.26 36.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.623 0.249 . . . . 0.0 110.429 177.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -60.87 -29.79 69.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.865 0.364 . . . . 0.0 111.11 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.429 ' O ' HG22 ' A' 3568 ' ' THR . 3.0 tmt_? -59.93 -42.5 94.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.58 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -87.65 -10.34 51.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.197 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.58 ' HG3' ' O ' ' A' 3563 ' ' VAL . 85.9 mtp -85.24 -18.91 32.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.813 0.339 . . . . 0.0 111.413 -179.018 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3568 ' ' THR . . . . . 0.429 HG22 ' O ' ' A' 3565 ' ' ARG . 12.0 t -82.96 -7.35 59.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.03 0.443 . . . . 0.0 110.529 -178.633 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 55.2 t -117.65 93.83 2.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-O 121.043 0.449 . . . . 0.0 110.202 178.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -74.67 108.11 7.21 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.569 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.8 m 154.59 -41.66 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.482 1.513 . . . . 0.0 107.669 -172.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -87.01 -26.11 23.92 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.179 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.853 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -132.62 163.56 28.63 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.931 177.472 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.618 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 42.1 t -128.29 136.63 51.26 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 170.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.804 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.2 126.11 51.73 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.609 HD11 HD11 ' A' 3661 ' ' ILE . 79.4 mt -127.87 153.85 46.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.904 -177.588 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.757 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -119.56 108.23 14.25 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.415 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.515 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.18 120.71 34.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.39 0.614 . . . . 0.0 110.337 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.564 ' HG ' HD12 ' A' 3577 ' ' LEU . 62.5 mt -123.09 145.32 45.69 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.855 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.62 126.73 22.16 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.377 2.051 . . . . 0.0 112.213 179.039 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 31.5 p -119.14 116.46 26.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.111 0.481 . . . . 0.0 109.871 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.32 146.05 16.39 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.464 -0.874 . . . . 0.0 112.23 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3583 ' ' ARG . . . . . 0.421 ' HE ' ' CG ' ' A' 3587 ' ' ASP . 36.3 mtm180 -59.64 -46.79 87.94 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.444 0.64 . . . . 0.0 109.771 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.572 ' O ' HG23 ' A' 3588 ' ' VAL . 4.8 m-20 -132.12 177.06 7.85 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.564 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -55.58 -43.0 75.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.931 0.396 . . . . 0.0 110.558 179.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.09 -46.5 90.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.246 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.534 ' O ' ' HG2' ' A' 3591 ' ' GLN . 15.0 t70 -63.47 -40.88 98.3 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.001 -178.26 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' 3584 ' ' ASP . 72.1 t -53.85 -47.18 63.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.774 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 94.2 t -60.62 -46.5 95.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.304 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 46.8 t -62.61 -44.94 95.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.404 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3591 ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' 3587 ' ' ASP . 72.1 mm-40 -64.35 -42.0 96.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.762 0.315 . . . . 0.0 110.287 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3592 ' ' THR . . . . . 0.424 ' O ' ' HG3' ' A' 3596 ' ' LYS . 57.8 m -59.63 -53.45 57.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.861 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' 3596 ' ' LYS . 11.2 pt-20 -65.5 -35.07 79.8 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 121.044 -0.263 . . . . 0.0 111.638 -177.091 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 38.1 m -65.43 -44.17 88.18 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.519 HD12 ' HB2' ' A' 3599 ' ' PHE . 53.3 tp -63.01 -44.76 95.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.476 178.397 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.572 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 58.9 mtpt -56.4 -58.18 9.1 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.67 177.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.44 -33.46 75.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.702 -175.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.597 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.62 -46.44 6.63 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -171.792 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.519 ' HB2' HD12 ' A' 3595 ' ' LEU . 19.8 m-85 -99.71 -50.46 4.04 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.79 0.329 . . . . 0.0 111.339 -173.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.572 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 23.4 mm -62.61 -52.6 57.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.032 -176.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 75.3 m -59.49 -45.25 92.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.037 178.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.718 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -66.6 -56.34 11.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.568 -178.14 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.718 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -55.18 -44.3 75.12 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -175.969 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -73.85 -34.23 64.42 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.685 -176.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.76 -38.4 80.07 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.207 0.527 . . . . 0.0 110.646 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -77.69 -18.64 56.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.445 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 50.72 53.74 12.45 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.484 -169.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.584 ' O ' HD12 ' A' 3603 ' ' LEU . . . -136.26 -175.53 4.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.734 -172.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.76 ' HB3' ' HB3' ' A' 3553 ' ' MET . . . -120.47 121.33 38.24 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.678 177.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3610 ' ' GLY . . . . . 0.521 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.92 101.53 0.49 Allowed Glycine 0 C--O 1.222 -0.654 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.142 177.311 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.664 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 29.3 mm -89.97 125.58 42.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.192 0.52 . . . . 0.0 110.928 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.688 HD13 ' HB3' ' A' 3547 ' ' LEU . 41.1 mt -124.63 117.32 50.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.714 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -83.34 141.81 31.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.285 -175.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.527 HG11 ' HA ' ' A' 3537 ' ' SER . 58.8 t . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.458 178.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.516 ' HB2' ' O ' ' A' 3614 ' ' VAL . 68.0 m-85 . . . . . 0 CA--C 1.502 -0.885 0 CA-C-O 121.441 0.639 . . . . 0.0 109.6 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.564 HG12 ' HG3' ' A' 3627 ' ' GLN . 6.1 t -131.67 113.18 22.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.016 -176.906 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.659 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -92.31 111.52 23.12 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 171.248 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.564 ' HG3' HG12 ' A' 3625 ' ' VAL . 50.2 mt-30 -94.33 110.28 22.05 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.757 -177.533 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.606 HG12 HG12 ' A' 3659 ' ' ILE . 46.8 mt -93.72 97.66 7.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.184 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -87.92 143.64 33.6 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.905 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.466 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 42.9 Cg_endo -67.58 171.07 12.49 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.554 2.169 . . . . 0.0 111.396 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.52 41.66 0.53 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 122.844 2.363 . . . . 0.0 112.816 178.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 15.4 p -75.7 161.7 28.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.919 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3633 ' ' GLU . . . . . 0.427 ' OE2' ' HB2' ' A' 3637 ' ' SER . 4.4 tm-20 -48.85 -44.23 39.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.763 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 21.3 t80 -49.38 -49.85 42.85 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.477 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.5 m -63.56 -54.96 27.89 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.962 -177.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3636 ' ' GLU . . . . . 0.432 ' HA ' HD12 ' A' 3639 ' ' LEU . 3.7 mm-40 -62.5 -34.25 76.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.993 -175.399 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3637 ' ' SER . . . . . 0.427 ' HB2' ' OE2' ' A' 3633 ' ' GLU . 34.2 t -61.22 -50.52 72.76 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.701 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3638 ' ' HIS . . . . . 0.408 ' HB3' HD12 ' A' 3642 ' ' LEU . 38.9 m-70 -65.28 -35.46 81.08 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.066 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3639 ' ' LEU . . . . . 0.446 HD13 HD12 ' A' 3650 ' ' ILE . 88.5 mt -63.89 -39.2 93.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.977 177.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3640 ' ' SER . . . . . 1.034 ' HA ' HD22 ' A' 3647 ' ' LEU . 33.6 t -59.72 -37.52 79.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.173 0.511 . . . . 0.0 110.718 177.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 31.6 mtp180 -83.88 -37.66 22.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.28 -179.126 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.804 HD13 HD22 ' A' 3575 ' ' LEU . 23.5 mt -87.69 -31.13 19.88 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -172.273 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.439 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -154.66 87.34 3.43 Favored Pre-proline 0 N--CA 1.465 0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 111.659 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -74.76 -21.75 16.12 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 122.577 2.185 . . . . 0.0 113.783 -175.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.25 -53.09 10.48 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.394 -0.523 . . . . 0.0 109.842 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.757 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -71.06 -26.44 63.08 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.858 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A 3647 ' ' LEU . . . . . 1.034 HD22 ' HA ' ' A' 3640 ' ' SER . 25.2 tp -53.27 -49.69 66.4 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.353 175.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -58.1 -27.2 63.48 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.016 0.436 . . . . 0.0 110.846 -178.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 13.6 m -77.85 -45.15 25.14 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.243 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.626 ' HA ' HG22 ' A' 3653 ' ' ILE . 3.8 pt -73.87 -20.13 17.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.82 0.343 . . . . 0.0 111.566 -175.055 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.5 m -58.09 -28.21 64.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.968 0.413 . . . . 0.0 110.309 175.307 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -88.51 -34.5 17.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.737 175.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.626 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.3 tp -104.99 42.68 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 122.662 1.22 . . . . 0.0 109.014 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.492 ' N ' ' HD2' ' A' 3655 ' ' PRO . 5.4 p -40.1 -38.0 0.95 Allowed Pre-proline 0 CA--C 1.54 0.587 0 CA-C-N 113.61 -1.632 . . . . 0.0 114.216 172.497 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' 3654 ' ' SER . 19.4 Cg_endo -62.95 78.57 0.11 Allowed 'Trans proline' 0 C--N 1.359 1.113 0 CA-C-N 120.832 1.333 . . . . 0.0 111.415 169.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3656 ' ' HIS . . . . . 0.469 ' HB2' HD23 ' A' 3579 ' ' LEU . 20.5 p80 -148.19 176.17 10.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.061 -177.073 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.486 HD22 HG22 ' A' 3628 ' ' ILE . 28.0 mt -122.49 152.34 40.41 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.204 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 13.4 tmm? -115.34 113.24 23.54 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 175.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.851 HD12 HD21 ' A' 3524 ' ' LEU . 80.9 mt -107.55 123.2 62.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.35 0.595 . . . . 0.0 111.971 -170.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.853 HG13 ' HD2' ' A' 3573 ' ' TYR . 78.9 t -108.25 112.7 41.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.644 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.659 HG12 ' HG ' ' A' 3626 ' ' LEU . 58.1 mt -90.57 112.33 24.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.679 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -128.35 143.46 51.01 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.437 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 14.6 m -94.42 107.97 19.91 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 42.8 t . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.455 -0.783 . . . . 0.0 110.193 -178.311 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.531 ' CD1' ' HB2' ' A' 3553 ' ' MET . 64.7 m-85 . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 119.677 -0.201 . . . . 0.0 111.403 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.621 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.8 OUTLIER 56.93 -160.9 0.22 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.526 0.679 . . . . 0.0 111.391 179.233 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.417 ' H ' ' HB3' ' B' 2519 ' ' GLU . 19.2 m -146.53 115.9 7.07 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 166.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.561 HD13 ' HD2' ' A' 3552 ' ' ARG . 20.3 tp . . . . . 0 N--CA 1.454 -0.254 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.817 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.578 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp . . . . . 0 C--O 1.226 -0.144 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.603 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.27 -15.55 62.92 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.818 -175.91 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.603 ' N ' HD13 ' A' 3502 ' ' LEU . 18.9 ttpp -65.21 -25.14 67.57 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.563 176.386 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -105.57 -42.14 5.28 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.745 175.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.671 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.27 108.75 3.19 Favored Pre-proline 0 CA--C 1.536 0.411 0 CA-C-O 121.38 0.609 . . . . 0.0 111.445 -178.624 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -85.49 174.54 6.79 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 124.221 3.281 . . . . 0.0 113.798 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.517 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.6 mt -72.14 134.46 29.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.03 -179.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.444 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.5 m -101.25 -31.92 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.504 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.638 ' CB ' HD13 ' A' 3538 ' ' LEU . 34.8 t-105 -149.08 152.53 36.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.745 0.307 . . . . 0.0 110.566 -177.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -145.51 118.18 8.62 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 175.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.75 -134.51 1.72 Allowed Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.61 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -139.76 151.35 45.73 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.296 0.569 . . . . 0.0 111.532 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.478 HD23 ' HB2' ' A' 3547 ' ' LEU . 73.9 mt -105.45 151.97 23.58 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 170.532 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.677 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.91 125.15 12.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.644 0.259 . . . . 0.0 111.572 -178.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.753 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.97 142.9 40.48 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 173.966 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.753 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 57.47 -93.39 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.496 0.497 . . . . 0.0 109.755 -169.838 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -140.65 7.33 2.1 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.42 ' HB3' ' HB1' ' A' 3598 ' ' ALA . 7.3 m-20 -95.09 144.14 25.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.059 -174.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 17.8 p -132.28 144.12 50.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.963 0.411 . . . . 0.0 111.472 -177.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -139.63 113.82 8.94 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.774 175.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.61 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.29 112.82 9.7 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 26.9 m -125.06 147.78 29.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.623 0.725 . . . . 0.0 112.237 -173.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -106.03 132.72 51.78 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.604 -1.18 . . . . 0.0 108.577 172.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.855 HD21 HD12 ' A' 3659 ' ' ILE . 1.1 mt -104.66 109.11 20.91 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.437 0.637 . . . . 0.0 111.738 -175.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.517 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 76.3 m-70 -84.42 138.44 32.83 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.106 -0.952 . . . . 0.0 108.638 175.485 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.671 ' O ' ' HB2' ' A' 3505 ' ' TYR . 61.5 t80 -68.05 137.46 55.05 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 174.334 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.552 ' CG1' HD23 ' A' 3575 ' ' LEU . 19.8 t -114.8 -56.76 4.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.281 0.562 . . . . 0.0 111.1 177.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 22.7 t -160.57 171.5 18.84 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.422 -173.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.45 -148.02 20.36 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.719 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.592 ' HB2' ' HA ' ' A' 3571 ' ' THR . 38.1 t30 -108.63 116.77 32.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.744 0.307 . . . . 0.0 110.975 -178.341 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -68.67 -23.53 64.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.167 -176.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3532 ' ' VAL . . . . . 0.451 ' O ' ' HG2' ' A' 3536 ' ' ARG . 90.0 t -59.71 -36.29 64.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.876 0.37 . . . . 0.0 110.313 177.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.51 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 59.1 mt -59.33 -37.42 77.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.874 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.43 ' HB1' ' CD1' ' A' 3538 ' ' LEU . . . -69.47 -41.4 76.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.619 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 15.6 t60 -60.39 -36.26 77.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.151 -177.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' 3532 ' ' VAL . 12.5 ptp180 -89.13 -26.66 21.21 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.2 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.626 ' O ' HG11 ' A' 3614 ' ' VAL . 72.8 p -86.72 -38.94 16.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.119 0.485 . . . . 0.0 110.904 -178.346 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.638 HD13 ' CB ' ' A' 3509 ' ' TRP . 22.0 mt -81.51 123.57 80.83 Favored Pre-proline 0 C--N 1.316 -0.855 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3539 ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' 3538 ' ' LEU . 6.2 Cg_endo . . . . . 0 N--CA 1.448 -1.154 0 C-N-CA 121.801 1.667 . . . . 0.0 111.383 -178.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 N--CA 1.462 -0.328 0 CA-C-O 121.1 0.375 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.689 ' HB3' HD13 ' A' 3612 ' ' ILE . 49.9 mt -81.82 112.74 19.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.261 177.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.677 ' HA ' ' O ' ' A' 3514 ' ' ALA . 21.7 ptt85 -90.34 141.51 28.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.871 0.367 . . . . 0.0 111.196 -177.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.522 HG22 HD12 ' B' 2521 ' ' LEU . 20.2 mt -95.02 107.14 19.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.865 0.841 . . . . 0.0 110.636 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.476 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -110.83 -4.15 15.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.594 -172.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.66 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 52.9 mt-30 -150.97 176.49 11.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.955 -0.111 . . . . 0.0 111.022 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.768 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -160.38 140.13 11.13 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -177.78 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.579 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -112.4 125.21 53.96 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.72 -0.218 . . . . 0.0 110.641 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3554 ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' 3554 ' ' ARG . 13.6 mmt85 -68.82 110.3 4.29 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.597 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -72.35 98.57 2.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 122.293 1.045 . . . . 0.0 110.318 -175.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.58 ' O ' ' HG ' ' A' 3560 ' ' LEU . 37.8 mt-10 -106.24 156.88 18.02 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.492 177.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.503 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -53.96 -50.24 66.95 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.125 0.266 . . . . 0.0 111.295 -177.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 18.7 p -63.98 -42.54 97.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.905 0.383 . . . . 0.0 111.246 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.505 ' O ' HG23 ' A' 3563 ' ' VAL . 80.9 mm-40 -61.37 -42.46 98.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.078 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.58 HD21 ' HB2' ' A' 3555 ' ' LEU . 94.0 mt -65.18 -31.9 73.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.199 -178.054 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' 3557 ' ' ALA . 22.4 mm-40 -66.78 -45.27 79.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.214 0.53 . . . . 0.0 109.636 175.393 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -57.66 -41.75 93.89 Favored Glycine 0 CA--C 1.519 0.291 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.036 174.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.581 ' O ' ' HG3' ' A' 3567 ' ' MET . 97.1 t -61.94 -46.75 95.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.843 0.354 . . . . 0.0 110.207 177.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -62.61 -25.48 68.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.541 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.464 ' O ' HG22 ' A' 3568 ' ' THR . 41.5 ttm105 -63.61 -34.58 78.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.64 178.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3566 ' ' ARG . . . . . 0.549 ' HG2' ' O ' ' A' 3563 ' ' VAL . 10.5 ptp180 -86.45 -18.97 30.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.19 0.519 . . . . 0.0 109.889 176.774 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.581 ' HG3' ' O ' ' A' 3563 ' ' VAL . 90.0 mtp -75.44 -22.29 57.47 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.917 -177.218 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3568 ' ' THR . . . . . 0.464 HG22 ' O ' ' A' 3565 ' ' ARG . 6.1 t -80.22 -8.65 59.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.126 0.489 . . . . 0.0 110.25 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.4 t -113.16 89.65 1.34 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.354 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.91 110.45 6.42 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.072 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.592 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 3.3 m 147.48 -39.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.894 1.677 . . . . 0.0 107.819 -177.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.02 -30.79 44.4 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.665 -179.261 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.806 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -133.43 167.14 20.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.068 178.464 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.637 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 35.2 t -128.11 137.06 51.97 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 172.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.763 HD22 HD13 ' A' 3642 ' ' LEU . 14.1 tp -106.43 125.52 51.1 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.622 HD11 HD11 ' A' 3661 ' ' ILE . 80.3 mt -128.23 155.22 44.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.177 0.513 . . . . 0.0 110.899 -177.405 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.729 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -122.12 108.53 13.45 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.407 179.367 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.465 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -95.0 125.91 39.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.289 0.566 . . . . 0.0 110.706 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.51 HD23 ' HB2' ' A' 3656 ' ' HIS . 75.3 mt -125.24 144.44 47.48 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.242 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -61.87 112.22 1.44 Allowed 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.347 2.031 . . . . 0.0 111.874 178.137 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 26.4 p -104.7 120.61 41.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.868 0.366 . . . . 0.0 110.345 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3582 ' ' GLY . . . . . 0.4 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.07 145.17 16.19 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.849 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -67.13 -38.55 85.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.743 0.782 . . . . 0.0 109.465 176.854 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.598 ' O ' HG23 ' A' 3588 ' ' VAL . 29.1 t70 -136.73 169.68 17.34 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.524 -1.216 . . . . 0.0 107.808 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -56.65 -37.1 70.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.287 0.494 . . . . 0.0 110.512 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -60.72 -46.55 89.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.285 0.564 . . . . 0.0 109.509 176.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.439 ' HB3' ' H ' ' A' 3584 ' ' ASP . 23.4 t70 -64.37 -42.54 96.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.785 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' 3584 ' ' ASP . 89.6 t -54.76 -47.49 74.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.776 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 87.8 t -58.95 -49.44 83.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.385 178.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 23.0 t -60.07 -48.91 79.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.765 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -63.37 -37.83 88.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.859 -0.155 . . . . 0.0 111.413 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 66.5 m -61.51 -52.0 66.28 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.068 0.461 . . . . 0.0 110.484 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.521 ' HA ' ' HG2' ' A' 3596 ' ' LYS . 26.9 mt-10 -68.55 -38.66 80.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.886 -179.293 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 18.3 t -58.03 -49.65 76.14 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.136 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.572 HD12 ' HB2' ' A' 3599 ' ' PHE . 57.8 tp -62.5 -46.69 87.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.327 -178.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.818 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 65.7 pttt -70.35 -33.85 71.95 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.143 -175.346 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -77.82 -37.34 48.84 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 121.041 -0.264 . . . . 0.0 111.709 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.42 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -91.96 -46.95 7.55 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -172.082 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.572 ' HB2' HD12 ' A' 3595 ' ' LEU . 14.8 m-85 -98.7 -49.74 4.49 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.637 0.256 . . . . 0.0 111.294 -174.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.818 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 25.1 mm -60.55 -55.31 25.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.708 -178.367 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 64.2 m -57.63 -38.46 75.03 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.208 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.744 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -68.84 -57.11 6.02 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.866 178.522 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.744 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.22 -41.91 76.4 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.569 0.223 . . . . 0.0 111.55 -177.212 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -72.05 -36.93 69.76 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.703 -177.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.33 -36.95 80.04 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.053 0.454 . . . . 0.0 110.758 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -79.61 -18.31 51.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.87 178.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3607 ' ' GLN . . . . . 0.537 ' O ' ' HG ' ' A' 3555 ' ' LEU . 72.7 mt-30 51.92 48.31 23.02 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -171.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.574 ' O ' HD12 ' A' 3603 ' ' LEU . . . -130.24 -175.93 3.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.295 -171.345 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.768 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.71 117.73 28.24 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.499 175.712 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3610 ' ' GLY . . . . . 0.439 ' N ' HD11 ' A' 3603 ' ' LEU . . . -66.21 105.4 1.27 Allowed Glycine 0 C--O 1.222 -0.641 0 C-N-CA 120.837 -0.696 . . . . 0.0 111.896 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.66 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 35.4 mm -89.69 125.91 42.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.223 0.535 . . . . 0.0 111.22 -175.318 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.689 HD13 ' HB3' ' A' 3547 ' ' LEU . 28.1 mt -121.23 114.72 44.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.302 178.001 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.533 ' HA ' ' O ' ' A' 3624 ' ' TYR . 91.5 m-20 -88.74 127.96 35.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.359 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.626 HG11 ' O ' ' A' 3537 ' ' SER . 4.8 t . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.187 -177.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.533 ' O ' ' HA ' ' A' 3613 ' ' ASN . 72.7 m-85 . . . . . 0 CA--C 1.513 -0.473 0 CA-C-O 121.044 0.449 . . . . 0.0 110.506 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.406 HG13 HG23 ' A' 3611 ' ' ILE . 4.3 t -126.67 114.07 36.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.851 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.619 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -98.42 114.88 27.4 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 169.481 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.515 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 65.4 mt-30 -94.5 110.92 22.68 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.605 HG12 HG12 ' A' 3659 ' ' ILE . 39.2 mt -92.38 98.7 8.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.279 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -88.55 142.59 31.2 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.917 177.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.507 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 48.2 Cg_endo -68.98 172.96 10.96 Favored 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 122.578 2.185 . . . . 0.0 111.308 176.103 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3631 ' ' PRO . . . . . 0.401 ' HD3' HD12 ' A' 3600 ' ' ILE . 56.4 Cg_endo -70.35 45.23 0.51 Allowed 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.078 2.519 . . . . 0.0 112.276 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.7 p -84.39 163.35 19.57 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.982 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -42.62 -49.85 5.47 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 123.959 0.787 . . . . 0.0 112.02 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3634 ' ' PHE . . . . . 0.506 ' HB2' HD13 ' A' 3560 ' ' LEU . 38.6 t80 -50.82 -48.12 59.82 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 123.339 0.399 . . . . 0.0 111.487 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.7 m -68.15 -58.43 4.47 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.629 -176.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -60.93 -41.15 95.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.427 -173.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 9.0 t -66.19 -44.97 82.42 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 120.927 0.394 . . . . 0.0 110.243 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 19.7 m80 -68.87 -30.13 68.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.629 178.726 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 68.9 mt -66.01 -40.66 91.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.846 175.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.475 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 32.7 t -67.1 -25.55 66.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.15 0.5 . . . . 0.0 110.181 177.47 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -83.86 -38.6 20.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.189 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.763 HD13 HD22 ' A' 3575 ' ' LEU . 12.7 mt -94.91 -31.4 13.69 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -172.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -149.08 75.27 9.82 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -175.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -67.91 -18.75 46.77 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.788 2.325 . . . . 0.0 111.782 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3645 ' ' ASP . . . . . 0.531 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 2.7 m-20 -71.11 -49.95 38.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.196 -177.166 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.729 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -83.05 -29.11 29.1 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.444 178.818 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.475 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.35 -43.83 71.64 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.97 0.414 . . . . 0.0 110.45 179.255 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -67.14 -18.46 65.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.233 -0.44 . . . . 0.0 112.098 -176.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 89.1 p -91.49 -26.19 18.92 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.227 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.627 ' HA ' HG22 ' A' 3653 ' ' ILE . 7.1 pt -88.07 -10.44 10.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.558 -177.03 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.2 p -58.58 -23.93 59.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.875 175.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 5.3 t30 -85.9 -36.51 19.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.094 0.473 . . . . 0.0 110.206 175.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.627 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.4 tp -104.47 38.95 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 122.379 1.085 . . . . 0.0 109.789 -178.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.442 ' N ' ' HD2' ' A' 3655 ' ' PRO . 50.7 m -36.78 -42.24 0.81 Allowed Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 114.157 -1.383 . . . . 0.0 113.947 170.527 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.451 ' HG2' HD12 ' A' 3653 ' ' ILE . 12.9 Cg_endo -59.75 77.44 0.06 OUTLIER 'Trans proline' 0 C--N 1.357 1.008 0 C-N-CA 121.533 1.489 . . . . 0.0 111.517 168.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3656 ' ' HIS . . . . . 0.51 ' HB2' HD23 ' A' 3579 ' ' LEU . 22.5 p80 -147.69 174.89 11.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.776 -177.165 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.479 HD22 HG22 ' A' 3628 ' ' ILE . 42.9 mt -120.76 149.85 41.91 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.525 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 16.2 tmm? -113.98 114.54 26.31 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.855 HD12 HD21 ' A' 3524 ' ' LEU . 74.8 mt -108.38 121.22 61.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.169 0.509 . . . . 0.0 111.811 -170.46 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.806 HG13 ' HD2' ' A' 3573 ' ' TYR . 76.1 t -105.34 114.77 45.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.918 -178.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.637 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 57.5 mt -91.15 118.45 36.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.314 178.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.5 127.66 55.77 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.654 0.264 . . . . 0.0 110.615 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A 3663 ' ' SER . . . . . 0.421 ' HB2' HD22 ' A' 3533 ' ' LEU . 33.6 t -91.73 122.35 34.2 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.41 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 C--O 1.251 1.154 0 CA-C-O 117.337 -1.316 . . . . 0.0 112.693 178.221 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.579 ' CD1' ' HB2' ' A' 3553 ' ' MET . 8.9 m-85 . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 111.619 0.229 . . . . 0.0 111.619 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.613 ' O ' ' HG2' ' A' 3551 ' ' GLN . 4.5 tt0 58.44 -155.81 0.34 Allowed 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.571 ' H ' ' CG ' ' B' 2519 ' ' GLU . 58.5 m -155.07 121.87 5.42 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 175.248 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.588 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.584 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp . . . . . 0 C--O 1.227 -0.086 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.655 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -69.4 -15.32 63.27 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.131 0.491 . . . . 0.0 110.163 -172.582 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.655 ' N ' HD13 ' A' 3502 ' ' LEU . 21.6 tptm -77.9 -25.92 48.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.491 ' HG3' ' OD2' ' A' 3645 ' ' ASP . 31.5 mmtp -89.44 -43.14 11.07 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.706 175.764 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.733 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -153.74 104.17 2.51 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.18 179.598 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -84.01 174.12 8.58 Favored 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 124.085 3.19 . . . . 0.0 114.091 -174.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.511 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.8 mt -71.39 135.69 27.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.115 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.414 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.7 m -104.75 -29.57 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.292 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.717 ' HE3' HD12 ' A' 3524 ' ' LEU . 45.4 t90 -150.02 155.36 39.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -150.9 127.12 10.57 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . 177.93 -125.81 1.03 Allowed Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.539 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.668 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.3 mp -141.01 158.54 43.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.089 0.471 . . . . 0.0 111.098 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.51 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 79.7 mt -112.05 152.55 28.07 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 169.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.62 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.85 123.31 12.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.802 0.334 . . . . 0.0 111.836 -177.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.782 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.42 142.12 39.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 172.957 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.782 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 60.4 -91.6 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 122.788 0.435 . . . . 0.0 110.034 -171.385 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 45.7 m-80 -142.98 7.04 1.6 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.16 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -99.73 138.04 37.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.714 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.515 HG22 ' HB2' ' A' 3514 ' ' ALA . 15.3 p -128.86 127.82 42.63 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.748 -177.237 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -119.96 120.88 37.64 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.745 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.638 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -75.48 117.05 16.86 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.414 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 30.2 m -129.95 148.36 33.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.417 0.627 . . . . 0.0 111.974 -174.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -110.29 128.71 55.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.259 -0.882 . . . . 0.0 108.872 172.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.866 HD21 HD12 ' A' 3659 ' ' ILE . 1.5 mt -95.6 113.02 24.62 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.186 -174.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.511 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 77.8 m-70 -88.45 141.79 28.25 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.785 175.556 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.733 ' O ' ' HB2' ' A' 3505 ' ' TYR . 64.3 t80 -71.77 139.71 49.15 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 172.566 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.582 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.4 t -115.23 -57.59 3.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.461 0.648 . . . . 0.0 110.719 176.081 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.521 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 68.9 m -159.42 171.77 19.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.175 -171.246 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.57 -149.06 20.33 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.792 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.482 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.4 t-20 -104.64 110.55 22.91 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.211 0.204 . . . . 0.0 110.664 -177.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.9 p30 -63.17 -30.93 71.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.538 -176.555 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 19.1 t -59.92 -33.47 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.88 0.372 . . . . 0.0 110.028 -179.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' A' 3530 ' ' ASN . 17.8 mt -56.71 -48.33 77.96 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.235 175.351 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.445 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.13 -38.23 89.95 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.413 0.625 . . . . 0.0 110.23 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -62.52 -40.21 96.03 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.27 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' 3536 ' ' ARG . 11.4 ptt180 -89.38 -10.01 48.19 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -179.397 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.427 ' HB2' HD11 ' A' 3626 ' ' LEU . 29.8 p -98.9 -41.82 7.43 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 122.015 -0.428 . . . . 0.0 111.506 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.683 HD13 ' HB2' ' A' 3509 ' ' TRP . 29.8 mt -78.84 111.27 18.4 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-O 121.142 0.496 . . . . 0.0 110.063 -173.533 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 N--CA 1.46 -0.445 0 C-N-CA 123.078 2.519 . . . . 0.0 112.474 -172.974 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 3546 ' ' PRO . . . . . 0.668 ' HA ' ' O ' ' A' 3512 ' ' LEU . 33.8 Cg_endo . . . . . 0 N--CA 1.462 -0.338 0 CA-C-O 120.922 0.301 . . . . 0.0 112.52 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.662 ' HB3' HD13 ' A' 3612 ' ' ILE . 24.4 mt -69.05 115.42 8.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.795 174.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.62 ' HA ' ' O ' ' A' 3514 ' ' ALA . 20.0 ptt180 -90.31 138.64 31.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.06 -176.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.47 ' O ' ' HB3' ' B' 2521 ' ' LEU . 20.8 mt -95.26 106.96 18.87 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 CA-C-O 122.152 0.977 . . . . 0.0 110.865 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.509 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.38 -2.05 14.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.581 -1.191 . . . . 0.0 111.695 -173.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.699 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 66.3 mt-30 -151.13 174.44 13.21 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.459 0.171 . . . . 0.0 111.331 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.75 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -157.0 136.43 12.15 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.357 -177.874 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.574 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 11.7 tmm? -110.03 121.11 44.48 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.288 177.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3554 ' ' ARG . . . . . 0.436 HH11 ' HD2' ' A' 3554 ' ' ARG . 9.3 mmt180 -63.3 111.35 2.23 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.542 ' HB2' HD21 ' A' 3560 ' ' LEU . 2.9 pp -71.84 97.32 1.79 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 122.472 1.13 . . . . 0.0 108.683 178.675 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.484 ' H ' ' HB2' ' A' 3559 ' ' GLN . 6.0 mm-40 -103.9 163.86 12.08 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.498 -177.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -58.45 -45.89 87.66 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.224 0.328 . . . . 0.0 110.18 176.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 44.8 p -66.07 -41.86 90.17 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.107 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.583 ' O ' HG23 ' A' 3563 ' ' VAL . 88.3 mm-40 -63.45 -49.71 72.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.13 -179.164 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.542 HD21 ' HB2' ' A' 3555 ' ' LEU . 79.7 mt -59.69 -37.51 79.02 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.512 -176.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' 3557 ' ' ALA . 7.4 mm-40 -56.58 -53.35 58.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.961 0.41 . . . . 0.0 110.06 175.14 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -60.89 -41.11 99.15 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.199 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' 3559 ' ' GLN . 91.9 t -60.52 -52.78 57.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.448 0.166 . . . . 0.0 110.635 178.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.5 91.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.787 0.327 . . . . 0.0 111.293 -178.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.541 ' O ' HG22 ' A' 3568 ' ' THR . 98.1 mtt180 -68.05 -27.26 66.37 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.595 -177.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -88.42 -20.08 25.71 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.229 -0.588 . . . . 0.0 110.503 172.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.429 ' HG3' ' O ' ' A' 3563 ' ' VAL . 76.8 mtp -74.69 -21.5 59.36 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.739 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3568 ' ' THR . . . . . 0.541 HG22 ' O ' ' A' 3565 ' ' ARG . 5.6 t -74.88 -7.32 53.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.113 0.483 . . . . 0.0 110.253 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.7 t -105.34 87.93 1.13 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.556 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.149 177.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -73.53 108.16 6.22 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.482 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.4 m 155.04 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.536 1.535 . . . . 0.0 107.811 -174.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -84.69 -24.96 28.73 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.934 -178.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.688 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -130.16 161.52 30.93 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.053 179.616 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.634 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 47.8 t -124.84 135.83 53.26 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 171.279 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.764 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.61 125.55 51.11 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.628 HD11 HD11 ' A' 3661 ' ' ILE . 76.8 mt -125.57 153.44 43.69 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.143 0.497 . . . . 0.0 110.951 -177.306 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.598 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -121.94 106.39 11.19 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.501 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.44 123.99 38.19 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.365 0.602 . . . . 0.0 110.24 -177.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.424 ' HG ' HD12 ' A' 3577 ' ' LEU . 79.1 mt -125.48 143.33 44.41 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.162 -178.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -61.36 113.33 1.73 Allowed 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.406 2.07 . . . . 0.0 111.637 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 28.0 p -100.89 111.69 23.96 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.096 0.474 . . . . 0.0 110.431 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3582 ' ' GLY . . . . . 0.461 ' H ' HG22 ' A' 3588 ' ' VAL . . . -104.07 146.08 16.23 Favored Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.727 177.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3583 ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' 3583 ' ' ARG . 29.4 ttt180 -60.61 -35.82 77.07 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-O 121.344 0.592 . . . . 0.0 110.92 178.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.585 ' O ' HG23 ' A' 3588 ' ' VAL . 28.1 t70 -140.44 169.54 17.47 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -53.59 -39.85 65.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 118.003 0.365 . . . . 0.0 111.181 -178.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -63.39 -44.6 94.24 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.202 0.525 . . . . 0.0 110.603 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.451 ' HB3' ' H ' ' A' 3584 ' ' ASP . 12.6 t70 -63.34 -39.73 95.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.908 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' 3584 ' ' ASP . 84.9 t -60.08 -41.48 86.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.945 178.62 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 4.9 t -62.59 -50.34 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 CA-C-O 121.555 0.693 . . . . 0.0 109.744 -178.105 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 37.1 m -59.84 -41.76 92.11 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 114.391 -1.277 . . . . 0.0 111.555 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -68.63 -38.23 80.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.48 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3592 ' ' THR . . . . . 0.437 ' O ' ' HG3' ' A' 3596 ' ' LYS . 86.6 m -58.55 -54.74 43.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.933 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -65.24 -33.4 75.9 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.965 -0.294 . . . . 0.0 111.2 -177.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 66.7 m -63.8 -45.94 87.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.421 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.568 HD12 ' HB2' ' A' 3599 ' ' PHE . 57.6 tp -62.95 -40.7 98.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.471 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.526 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 55.1 mtpt -58.74 -59.43 5.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.888 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.63 -29.53 69.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -174.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.64 -47.68 6.11 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -173.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.568 ' HB2' HD12 ' A' 3595 ' ' LEU . 23.5 m-85 -100.72 -50.26 3.92 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -174.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.526 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.4 mm -62.35 -58.59 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.893 -175.155 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 32.5 m -59.63 -31.61 69.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.237 -178.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.774 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -72.62 -58.61 3.23 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.812 177.752 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.774 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.37 -42.54 78.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.567 0.223 . . . . 0.0 111.56 -178.161 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -69.85 -38.15 76.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.6 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.22 -40.17 74.7 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.009 0.433 . . . . 0.0 110.499 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -73.98 -19.05 60.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.001 178.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3607 ' ' GLN . . . . . 0.496 ' O ' ' HG ' ' A' 3555 ' ' LEU . 85.6 mt-30 48.72 52.46 13.93 Favored 'General case' 0 C--O 1.23 0.068 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 -169.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.516 ' O ' HD12 ' A' 3603 ' ' LEU . . . -130.96 -175.96 3.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.978 -0.556 . . . . 0.0 112.197 -173.055 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.75 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.92 117.47 27.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.306 175.361 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.39 103.73 0.79 Allowed Glycine 0 C--O 1.222 -0.653 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.338 178.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.699 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.4 mm -89.28 120.23 37.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.207 0.527 . . . . 0.0 111.377 -173.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.662 HD13 ' HB3' ' A' 3547 ' ' LEU . 30.5 mt -122.53 105.29 15.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.825 175.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.529 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.8 m120 -83.65 125.06 31.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.866 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 34.5 m . . . . . 0 C--N 1.32 -0.702 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.443 178.929 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.529 ' O ' ' HA ' ' A' 3613 ' ' ASN . 79.3 m-85 . . . . . 0 CA--C 1.51 -0.59 0 CA-C-O 120.829 0.347 . . . . 0.0 110.492 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.517 HG13 HG23 ' A' 3611 ' ' ILE . 9.9 t -122.74 115.75 46.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.237 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.663 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -95.55 110.03 22.17 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 170.673 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.495 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 61.5 mt-30 -94.5 110.74 22.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.692 -177.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.595 HG12 HG12 ' A' 3659 ' ' ILE . 31.6 mt -89.75 98.27 7.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.126 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -87.54 144.5 35.61 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.875 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.647 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 58.8 Cg_endo -71.7 170.18 19.3 Favored 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.576 2.184 . . . . 0.0 111.404 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3631 ' ' PRO . . . . . 0.4 ' HD3' ' O ' ' A' 3656 ' ' HIS . 36.9 Cg_endo -67.96 77.61 0.59 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.362 2.041 . . . . 0.0 110.969 174.701 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3632 ' ' CYS . . . . . 0.549 ' O ' ' HG2' ' A' 3636 ' ' GLU . 8.4 p -111.95 162.77 14.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.297 -171.15 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -48.84 -39.28 24.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.993 176.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 46.6 t80 -58.18 -55.95 28.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.231 176.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 33.8 p -66.23 -54.16 28.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.481 -174.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3636 ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.8 mm-40 -61.32 -35.15 76.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.795 -171.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 45.8 m -71.87 -46.0 59.38 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.058 0.456 . . . . 0.0 110.554 -178.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 53.0 m80 -63.32 -35.67 81.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.148 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.46 -32.9 74.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.031 176.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3640 ' ' SER . . . . . 1.088 ' HA ' HD22 ' A' 3647 ' ' LEU . 17.5 t -65.32 -35.76 81.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 0.0 110.08 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.97 -54.71 5.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.012 177.039 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.764 HD13 HD22 ' A' 3575 ' ' LEU . 28.2 mt -67.23 -39.62 86.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.463 -0.789 . . . . 0.0 112.821 -171.013 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.419 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -147.61 75.24 11.24 Favored Pre-proline 0 C--N 1.327 -0.385 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3644 ' ' PRO . . . . . 0.524 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 48.9 Cg_endo -69.52 -19.9 36.65 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.412 2.075 . . . . 0.0 111.752 178.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3645 ' ' ASP . . . . . 0.491 ' OD2' ' HG3' ' A' 3504 ' ' LYS . 43.6 m-20 -70.68 -51.66 26.22 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.026 -177.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.598 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -79.52 -28.01 41.35 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A 3647 ' ' LEU . . . . . 1.088 HD22 ' HA ' ' A' 3640 ' ' SER . 25.4 tp -52.06 -48.47 64.61 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.618 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.88 -20.33 63.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.492 -176.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 8.3 t -89.58 -33.56 16.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.175 178.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.606 ' HA ' HG22 ' A' 3653 ' ' ILE . 6.3 pt -80.81 -16.78 12.44 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.849 179.152 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 6.1 t -59.88 -21.14 60.62 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.41 0.624 . . . . 0.0 109.685 174.191 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -88.14 -39.21 14.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.353 174.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.606 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -105.22 43.15 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 122.461 1.124 . . . . 0.0 109.439 -179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.471 ' N ' ' HD2' ' A' 3655 ' ' PRO . 20.3 m -37.19 -42.97 1.06 Allowed Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 113.98 -1.464 . . . . 0.0 113.524 172.453 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.52 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.8 Cg_endo -60.22 82.43 0.07 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.432 1.421 . . . . 0.0 111.661 168.348 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3656 ' ' HIS . . . . . 0.414 ' HB2' HD23 ' A' 3579 ' ' LEU . 25.7 p80 -148.18 174.64 11.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.145 -177.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.448 HD22 HG22 ' A' 3628 ' ' ILE . 39.1 mt -120.96 150.34 41.26 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.446 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 59.2 ttp -111.82 109.65 19.59 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 173.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.866 HD12 HD21 ' A' 3524 ' ' LEU . 83.5 mt -101.31 114.76 41.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 121.248 0.547 . . . . 0.0 111.19 -173.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.688 HG13 ' HD2' ' A' 3573 ' ' TYR . 72.4 t -101.1 114.54 40.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.799 -177.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.663 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.0 mt -90.51 112.09 24.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -117.12 129.21 55.82 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 120.882 0.372 . . . . 0.0 111.621 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 27.9 m -103.02 108.45 19.63 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 169.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.328 179.36 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.574 ' CD1' ' HB2' ' A' 3553 ' ' MET . 31.0 m-85 . . . . . 0 N--CA 1.482 1.134 0 CA-C-O 119.745 -0.169 . . . . 0.0 111.408 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.534 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.5 OUTLIER 53.49 -155.54 0.21 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.761 0.791 . . . . 0.0 111.419 179.143 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.465 ' H ' ' HB3' ' B' 2519 ' ' GLU . 98.5 m -153.14 123.22 6.98 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.577 -1.192 . . . . 0.0 107.996 167.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.573 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.343 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -177.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.573 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp . . . . . 0 CA--C 1.53 0.183 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.646 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -69.82 -15.81 63.17 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.557 0.617 . . . . 0.0 110.243 -172.363 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.602 ' N ' HD13 ' A' 3502 ' ' LEU . 28.2 mtpp -68.21 -24.73 64.97 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.2 175.721 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.426 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 28.4 mmtp -101.59 -42.56 6.18 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.232 176.198 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.744 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -144.3 99.35 4.96 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-O 121.503 0.668 . . . . 0.0 110.533 179.414 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 3506 ' ' PRO . . . . . 0.646 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 92.6 Cg_endo -83.52 173.04 9.88 Favored 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 124.128 3.219 . . . . 0.0 113.958 -174.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.497 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 82.0 mt -73.64 138.6 20.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.394 -177.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 23.1 m -108.58 -31.42 2.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.217 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.818 ' CD1' HD12 ' A' 3524 ' ' LEU . 2.2 t-105 -138.75 148.84 44.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.391 -177.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -146.59 119.2 8.53 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 170.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3511 ' ' GLY . . . . . 0.471 ' O ' ' HA ' ' A' 3521 ' ' ALA . . . 177.97 -129.81 1.49 Allowed Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -175.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.604 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 4.9 mp -139.76 153.6 47.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.504 0.652 . . . . 0.0 111.931 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.466 HD23 ' HB2' ' A' 3547 ' ' LEU . 69.1 mt -106.15 154.12 21.13 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 167.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.673 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -142.83 121.86 12.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 117.97 0.35 . . . . 0.0 111.829 -177.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.758 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.34 147.09 41.08 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 172.797 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.758 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.8 OUTLIER 63.57 -99.25 0.07 Allowed 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -170.11 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -139.39 5.79 2.28 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.694 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 1.6 t0 -103.23 139.05 39.2 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.815 -172.142 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' 3514 ' ' ALA . 14.7 p -122.65 127.94 49.98 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.896 -177.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -115.74 115.51 26.46 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.602 177.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.604 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.01 112.67 6.57 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 121.299 0.571 . . . . 0.0 109.634 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.418 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 30.9 m -127.36 147.64 32.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.678 -176.338 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -107.48 124.3 49.68 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.018 173.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.845 HD21 HD12 ' A' 3659 ' ' ILE . 4.8 mt -94.52 113.14 24.94 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.626 -176.368 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.497 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 53.2 m-70 -91.03 142.6 27.6 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.688 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.744 ' O ' ' HB2' ' A' 3505 ' ' TYR . 60.0 t80 -70.02 137.31 51.24 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 172.522 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.571 ' CG1' HD23 ' A' 3575 ' ' LEU . 22.1 t -115.31 -55.8 4.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-O 121.383 0.611 . . . . 0.0 110.86 176.073 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.497 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 69.7 m -161.41 172.43 16.52 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.138 -171.253 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 84.51 -153.13 28.46 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.512 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.545 ' HB2' ' HA ' ' A' 3571 ' ' THR . 31.1 t30 -99.46 111.23 23.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.579 0.228 . . . . 0.0 111.102 -177.093 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -61.83 -29.02 69.89 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.313 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 98.7 t -58.79 -34.23 51.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.545 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.548 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 57.1 mt -59.3 -42.4 91.23 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.111 178.313 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.52 89.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.916 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -59.1 -38.72 80.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.166 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 9.0 ptm85 -88.5 -18.61 27.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -176.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.512 ' HB2' HD11 ' A' 3626 ' ' LEU . 43.9 p -92.27 -40.24 11.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.911 0.386 . . . . 0.0 111.193 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.629 HD13 ' HB2' ' A' 3509 ' ' TRP . 34.3 mt -79.39 120.98 82.29 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-O 121.108 0.48 . . . . 0.0 110.024 -174.105 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo . . . . . 0 CA--C 1.53 0.323 0 C-N-CA 123.429 2.752 . . . . 0.0 112.503 -177.116 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo . . . . . 0 C--O 1.233 0.272 0 N-CA-C 111.276 -0.317 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.66 ' HB3' HD13 ' A' 3612 ' ' ILE . 36.9 mt -68.24 108.49 3.2 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' A' 3514 ' ' ALA . 19.3 ptt180 -97.41 138.48 34.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.056 0.455 . . . . 0.0 111.301 -175.711 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.465 HD12 HD22 ' A' 3515 ' ' LEU . 18.9 mt -91.15 106.68 17.82 Favored 'Isoleucine or valine' 0 C--O 1.247 0.938 0 CA-C-O 122.068 0.937 . . . . 0.0 111.105 -175.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.516 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.5 -1.45 14.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.81 -173.194 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.688 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 39.9 mt-30 -148.1 173.21 13.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.41 0.148 . . . . 0.0 110.863 177.007 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.608 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -150.91 140.91 22.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.004 0.431 . . . . 0.0 111.402 -179.686 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.669 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 21.7 ttt -109.53 124.93 51.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.089 178.257 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3554 ' ' ARG . . . . . 0.415 ' HG2' ' H ' ' A' 3554 ' ' ARG . 14.3 mmt180 -64.58 110.04 2.19 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.557 ' O ' HD12 ' A' 3555 ' ' LEU . 3.6 pp -79.24 97.57 6.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 118.559 -1.256 . . . . 0.0 108.605 176.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.552 ' O ' ' HG ' ' A' 3560 ' ' LEU . 44.9 mt-10 -118.07 164.03 15.73 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.471 -1.24 . . . . 0.0 109.225 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.484 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -49.99 -53.69 24.95 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.394 0.434 . . . . 0.0 111.52 -178.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 23.5 p -64.51 -39.81 94.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.482 -178.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.559 ' O ' HG23 ' A' 3563 ' ' VAL . 15.0 mm100 -66.75 -40.19 88.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.973 -179.089 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' 3556 ' ' GLU . 92.1 mt -61.19 -34.54 75.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.816 179.386 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.56 ' O ' ' HD3' ' A' 3565 ' ' ARG . 7.9 mm-40 -60.19 -49.67 76.69 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 174.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.58 -41.42 99.57 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.702 178.139 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' 3559 ' ' GLN . 57.7 t -60.43 -44.77 96.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.731 0.301 . . . . 0.0 110.28 177.37 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -57.2 -36.82 71.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.394 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.56 ' HD3' ' O ' ' A' 3561 ' ' GLU . 10.5 mpt_? -58.31 -45.15 88.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.735 -0.211 . . . . 0.0 111.506 179.406 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3566 ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' 3563 ' ' VAL . 18.8 ptp180 -78.77 -16.34 57.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.861 0.362 . . . . 0.0 110.452 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.446 ' HG3' ' O ' ' A' 3563 ' ' VAL . 80.8 mtp -85.45 -22.01 28.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.575 0.702 . . . . 0.0 109.92 176.329 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 1.4 m -74.82 -23.46 58.47 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.26 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 39.7 t -98.01 87.76 1.64 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.358 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -74.23 107.72 6.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.36 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.545 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.6 m 150.57 -44.76 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.436 1.494 . . . . 0.0 107.769 -172.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.61 -31.1 24.45 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.832 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.861 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -119.62 158.93 25.39 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.213 0.53 . . . . 0.0 109.777 177.395 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.602 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 42.2 t -122.4 136.87 54.98 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 170.596 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.771 HD22 HD13 ' A' 3642 ' ' LEU . 14.2 tp -104.81 125.69 51.12 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.678 HD11 HD11 ' A' 3661 ' ' ILE . 70.6 mt -126.35 154.7 43.16 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.546 -177.383 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.692 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -122.08 107.03 11.72 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.099 179.697 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.517 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.14 120.25 34.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.489 0.662 . . . . 0.0 110.356 -178.403 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.547 ' HG ' HD12 ' A' 3577 ' ' LEU . 57.8 mt -122.18 146.34 46.49 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.791 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.23 116.9 3.56 Favored 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.145 1.897 . . . . 0.0 111.551 176.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 30.3 p -104.43 117.07 33.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.117 0.484 . . . . 0.0 109.97 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3582 ' ' GLY . . . . . 0.478 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.42 138.59 14.08 Favored Glycine 0 N--CA 1.437 -1.271 0 C-N-CA 120.262 -0.971 . . . . 0.0 111.82 178.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3583 ' ' ARG . . . . . 0.488 ' HG3' ' OD2' ' A' 3587 ' ' ASP . 33.0 mtt85 -70.24 -30.46 67.53 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.706 0.765 . . . . 0.0 109.093 177.396 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.505 ' O ' HG23 ' A' 3588 ' ' VAL . 3.9 p30 -140.04 174.57 10.39 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.956 178.192 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -60.47 -40.73 92.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.825 0.345 . . . . 0.0 111.115 -175.109 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3586 ' ' GLU . . . . . 0.412 ' HB3' ' OD1' ' A' 3584 ' ' ASP . 35.0 tt0 -67.19 -44.41 79.7 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.057 0.456 . . . . 0.0 109.922 178.023 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.488 ' OD2' ' HG3' ' A' 3583 ' ' ARG . 5.5 t70 -55.98 -45.68 78.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.58 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' 3584 ' ' ASP . 74.1 t -55.26 -54.7 22.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.828 178.048 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 82.1 t -58.4 -46.75 89.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.353 -178.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 46.9 t -60.54 -49.8 76.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.198 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -67.36 -30.34 70.11 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -177.619 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 83.2 m -61.92 -48.21 81.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.998 0.428 . . . . 0.0 110.026 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.9 -46.31 71.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.25 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 19.3 m -55.45 -47.51 75.93 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.517 178.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.608 HD12 ' HB2' ' A' 3599 ' ' PHE . 65.3 tp -63.57 -41.91 98.35 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.01 0.433 . . . . 0.0 110.332 176.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.593 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 1.9 ttmt -61.18 -50.12 74.45 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.011 -179.159 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3597 ' ' ALA . . . . . 0.419 ' N ' ' HG2' ' A' 3596 ' ' LYS . . . -73.66 -35.78 65.27 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -179.266 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.534 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -90.49 -46.35 8.38 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -171.431 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.633 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 11.6 m-85 -99.58 -50.0 4.22 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.822 0.344 . . . . 0.0 111.387 -175.371 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 28.5 mm -62.12 -58.69 6.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.735 -176.307 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 59.2 m -57.75 -38.54 75.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.247 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.694 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -67.72 -53.13 29.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.749 0.309 . . . . 0.0 110.627 179.277 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.694 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -69.21 -34.53 75.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.148 -170.225 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -70.58 -36.82 73.78 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.45 -37.71 74.36 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.816 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3606 ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' A' 3602 ' ' TYR . 72.4 mmtt -73.56 -19.51 60.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.703 178.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3607 ' ' GLN . . . . . 0.447 ' O ' ' HG ' ' A' 3555 ' ' LEU . 74.6 mt-30 48.95 50.68 17.39 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -169.053 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -132.92 170.67 15.0 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.245 -172.207 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.669 ' HB3' ' HB3' ' A' 3553 ' ' MET . . . -105.27 118.15 35.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.258 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.68 105.89 1.3 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.336 177.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.688 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 34.4 mm -90.02 122.1 41.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-O 121.22 0.533 . . . . 0.0 111.181 -174.323 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.66 HD13 ' HB3' ' A' 3547 ' ' LEU . 32.4 mt -120.84 117.08 51.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.702 175.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 14.9 m120 -95.42 126.01 40.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.356 -176.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 32.1 m . . . . . 0 C--N 1.32 -0.681 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.351 177.927 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 3624 ' ' TYR . . . . . . . . . . . . . 57.5 m-85 . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 121.136 0.493 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.519 HG12 ' HG3' ' A' 3627 ' ' GLN . 2.8 t -124.23 118.01 52.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.059 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -96.28 111.3 23.41 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 171.389 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.53 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 76.2 mt-30 -94.18 110.94 22.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.953 -178.372 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.592 HG12 HG12 ' A' 3659 ' ' ILE . 26.3 mt -92.94 99.46 9.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.356 -179.409 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -89.01 138.08 29.34 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.001 178.305 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.631 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 45.0 Cg_endo -68.05 168.83 17.91 Favored 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.639 2.226 . . . . 0.0 111.186 176.394 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -65.36 81.43 0.22 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.469 2.113 . . . . 0.0 111.673 177.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3632 ' ' CYS . . . . . 0.542 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.9 p -113.24 162.6 15.82 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.523 -176.345 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -54.89 -35.81 64.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.832 0.349 . . . . 0.0 110.323 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 40.0 t80 -53.96 -53.59 50.77 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.114 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3635 ' ' SER . . . . . 0.423 ' O ' ' HG ' ' A' 3639 ' ' LEU . 49.9 p -69.92 -53.65 16.95 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.873 -177.543 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3636 ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' 3632 ' ' CYS . 20.6 mm-40 -61.12 -43.86 98.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.857 -172.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 41.6 t -66.56 -43.49 84.88 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.118 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 12.6 m80 -64.0 -36.22 83.27 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.544 176.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3639 ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' 3635 ' ' SER . 79.0 mt -64.93 -42.37 94.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.959 177.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.779 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 36.6 t -58.41 -35.13 71.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.267 0.556 . . . . 0.0 110.448 178.042 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -79.83 -50.24 10.8 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.823 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.771 HD13 HD22 ' A' 3575 ' ' LEU . 19.7 mt -75.31 -38.3 60.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.46 -171.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.467 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -146.54 87.56 6.4 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.806 0.336 . . . . 0.0 111.332 -179.429 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.66 -24.98 21.19 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.587 2.191 . . . . 0.0 113.712 -174.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 4.1 t70 -80.31 -40.28 27.1 Favored 'General case' 0 CA--C 1.513 -0.444 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.534 -171.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.692 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.82 -29.4 44.75 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 176.559 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.779 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.26 -44.64 71.99 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.046 176.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -59.37 -34.58 72.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.903 0.382 . . . . 0.0 111.067 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 18.9 m -71.15 -41.8 69.96 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.916 0.389 . . . . 0.0 110.684 177.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.579 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.2 pt -79.59 -17.58 12.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.514 -173.33 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 48.8 m -57.74 -26.14 61.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.148 0.499 . . . . 0.0 110.441 174.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -87.4 -37.39 17.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.141 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.579 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.2 tp -104.91 43.64 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 122.406 1.098 . . . . 0.0 109.198 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.476 ' N ' ' HD2' ' A' 3655 ' ' PRO . 7.7 t -37.63 -43.46 1.41 Allowed Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 114.003 -1.453 . . . . 0.0 113.22 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.532 ' HG2' HD12 ' A' 3653 ' ' ILE . 15.3 Cg_endo -59.16 87.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 121.437 1.425 . . . . 0.0 111.601 169.522 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -154.83 177.95 10.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.399 -177.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.5 ' HB3' HG23 ' A' 3628 ' ' ILE . 43.5 mt -126.78 133.47 50.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.658 -179.058 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.7 tmm? -99.69 112.56 24.79 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.845 HD12 HD21 ' A' 3524 ' ' LEU . 75.8 mt -108.93 120.86 61.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 121.331 0.586 . . . . 0.0 111.838 -170.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.861 HG13 ' HD2' ' A' 3573 ' ' TYR . 63.7 t -103.65 116.64 47.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.779 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.678 HD11 HD11 ' A' 3576 ' ' LEU . 57.8 mt -90.69 111.78 24.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 176.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.51 128.68 56.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.781 0.324 . . . . 0.0 111.404 -176.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 14.8 m -77.66 119.82 21.74 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.885 173.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 52.6 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.677 -0.677 . . . . 0.0 109.713 177.72 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.473 ' CD2' ' HB2' ' A' 3553 ' ' MET . 42.4 m-85 . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 111.347 0.129 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.987 ' HG3' ' H ' ' B' 2520 ' ' THR . 6.7 tp10 58.0 -150.79 0.43 Allowed 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 177.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.987 ' H ' ' HG3' ' B' 2519 ' ' GLU . 33.7 m -154.98 126.59 7.44 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 174.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.555 HD13 ' HD2' ' A' 3552 ' ' ARG . 36.2 tp . . . . . 0 CA--C 1.515 -0.385 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.709 176.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.571 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp . . . . . 0 CA--C 1.532 0.277 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.626 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.38 -15.61 63.78 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.682 -173.929 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.626 ' N ' HD13 ' A' 3502 ' ' LEU . 23.3 ttmm -61.46 -38.42 87.17 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.063 0.459 . . . . 0.0 110.14 176.096 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.558 ' HD2' ' CD2' ' A' 3505 ' ' TYR . 7.5 tmtt? -94.66 -41.96 9.02 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.354 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.744 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -144.4 100.89 4.77 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.375 -177.111 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -87.61 173.43 5.33 Favored 'Trans proline' 0 CA--C 1.531 0.356 0 C-N-CA 124.257 3.304 . . . . 0.0 113.364 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.509 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 85.9 mt -71.6 128.96 35.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.719 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.472 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.0 m -98.48 -29.69 3.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.36 -178.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.571 ' CB ' HD13 ' A' 3538 ' ' LEU . 6.4 t-105 -153.57 158.16 40.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.21 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 25.1 tt0 -150.45 119.76 6.84 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 177.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.16 -132.56 1.41 Allowed Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.758 -0.734 . . . . 0.0 111.276 -176.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.635 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -139.85 153.21 46.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.056 0.455 . . . . 0.0 111.063 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.484 HD23 ' HB2' ' A' 3547 ' ' LEU . 73.7 mt -110.58 150.53 28.81 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 171.276 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.681 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.3 125.42 15.4 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -177.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.577 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.67 143.98 39.42 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 171.89 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.577 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.2 OUTLIER 62.29 -94.94 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 -168.784 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 13.4 m120 -142.66 5.74 1.6 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.727 174.187 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.411 ' O ' ' HA ' ' A' 3514 ' ' ALA . 26.4 m-20 -92.96 136.18 33.49 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.964 0.412 . . . . 0.0 110.727 -175.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.525 HG22 ' HB2' ' A' 3514 ' ' ALA . 13.4 p -123.98 140.69 52.73 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.219 -177.002 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.41 115.65 14.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.12 176.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.635 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -69.7 118.63 12.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.212 0.529 . . . . 0.0 109.857 175.27 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 27.3 m -131.07 147.55 33.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.82 -176.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3523 ' ' GLN . . . . . 0.427 ' NE2' ' NE2' ' A' 3525 ' ' HIS . 14.8 pt20 -105.59 125.74 51.34 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.036 173.383 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.833 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -95.24 108.17 20.31 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.805 -175.797 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.509 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 71.4 m-70 -83.75 140.97 31.76 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.678 174.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.744 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.4 t80 -68.6 140.58 55.56 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 172.558 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.575 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.5 t -116.15 -53.06 4.58 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.373 0.606 . . . . 0.0 110.903 175.591 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.453 ' OG ' HD22 ' A' 3642 ' ' LEU . 39.4 t -162.38 170.81 18.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.268 -171.277 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.54 -147.83 20.19 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.885 176.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.544 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.8 t-20 -107.99 114.66 28.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.853 0.358 . . . . 0.0 110.845 -177.153 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -62.17 -32.37 72.98 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.811 -177.101 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3532 ' ' VAL . . . . . 0.518 ' O ' ' HG2' ' A' 3536 ' ' ARG . 45.4 t -60.06 -35.6 62.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.148 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.494 HD23 ' HD3' ' A' 3536 ' ' ARG . 16.9 mt -55.6 -40.24 71.79 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.404 177.525 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.503 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.31 -44.57 83.08 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.452 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 5.2 t60 -63.82 -32.49 74.02 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.049 -178.496 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.518 ' HG2' ' O ' ' A' 3532 ' ' VAL . 10.8 ptm180 -88.62 -11.69 44.73 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.196 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.491 ' HB2' HD11 ' A' 3626 ' ' LEU . 34.2 p -103.92 -40.37 6.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 111.396 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.571 HD13 ' CB ' ' A' 3509 ' ' TRP . 16.7 mt -80.2 114.42 46.76 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -176.22 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo . . . . . 0 N--CA 1.457 -0.622 0 C-N-CA 122.174 1.916 . . . . 0.0 111.871 -179.316 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A 3546 ' ' PRO . . . . . 0.516 ' HA ' ' O ' ' A' 3512 ' ' LEU . 6.3 Cg_exo . . . . . 0 N--CA 1.457 -0.67 0 CA-C-O 121.005 0.336 . . . . 0.0 112.318 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.671 ' HB3' HD13 ' A' 3612 ' ' ILE . 42.7 mt -69.32 110.93 4.9 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.015 176.399 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.681 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -96.97 138.37 34.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.116 0.484 . . . . 0.0 111.103 -177.541 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.5 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.3 mt -87.93 112.38 23.5 Favored 'Isoleucine or valine' 0 C--O 1.242 0.666 0 CA-C-O 121.872 0.844 . . . . 0.0 111.422 -173.227 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.592 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -121.47 4.9 10.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.786 -174.564 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.714 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 48.8 mt-30 -152.23 173.06 15.46 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.63 177.081 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.743 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.47 139.41 11.76 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.855 0.359 . . . . 0.0 111.654 -179.478 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.594 ' HB2' ' CD2' ' B' 2518 ' ' TYR . 13.7 tmm? -111.92 120.11 40.79 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.076 176.236 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -68.55 110.01 4.01 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.596 ' O ' HD12 ' A' 3555 ' ' LEU . 2.5 pp -69.77 98.38 1.2 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 122.241 1.02 . . . . 0.0 110.006 -175.031 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.614 ' O ' ' HG ' ' A' 3560 ' ' LEU . 38.1 mm-40 -116.83 159.16 22.78 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.535 179.516 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.509 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -50.19 -50.13 50.29 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.321 0.388 . . . . 0.0 111.392 -177.149 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 5.9 p -63.28 -43.91 96.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.646 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.481 ' O ' HG23 ' A' 3563 ' ' VAL . 16.9 mm-40 -66.28 -38.97 89.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.302 -178.257 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' 3556 ' ' GLU . 87.4 mt -61.95 -35.02 77.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.568 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' 3557 ' ' ALA . 76.1 mm-40 -60.91 -47.17 87.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.951 174.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -59.49 -35.74 86.61 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.637 176.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.523 ' O ' ' HG3' ' A' 3567 ' ' MET . 60.2 t -67.5 -53.66 30.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.828 0.347 . . . . 0.0 110.208 176.619 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3564 ' ' ALA . . . . . 0.486 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.1 -26.58 66.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.489 -178.461 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -58.33 -40.25 81.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3566 ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' 3563 ' ' VAL . 12.0 ptp180 -88.38 -14.3 38.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.927 0.394 . . . . 0.0 110.791 177.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.523 ' HG3' ' O ' ' A' 3563 ' ' VAL . 88.1 mtp -79.03 -26.61 43.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.166 -178.886 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 8.5 t -74.99 -9.09 58.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.059 0.457 . . . . 0.0 110.644 -178.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 42.3 t -115.95 91.15 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.061 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -70.43 108.06 4.1 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 178.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.544 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.0 m 153.19 -46.22 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 O-C-N 125.046 1.466 . . . . 0.0 108.089 -173.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.31 -25.94 33.51 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.929 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.684 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -128.91 162.6 27.15 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.016 177.751 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.651 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 31.1 t -126.53 135.14 50.91 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.753 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.83 125.97 51.62 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.605 HD11 HD11 ' A' 3661 ' ' ILE . 67.7 mt -126.3 155.88 41.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.297 0.57 . . . . 0.0 111.035 -176.664 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.583 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -124.24 107.06 10.8 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.94 -179.689 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.472 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.64 119.74 33.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.379 0.609 . . . . 0.0 110.346 -177.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.445 ' HG ' HD12 ' A' 3577 ' ' LEU . 74.5 mt -119.44 143.78 35.23 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.238 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.93 112.8 1.4 Allowed 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 122.429 2.086 . . . . 0.0 111.641 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 28.5 p -101.93 113.49 26.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.196 0.522 . . . . 0.0 110.517 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.85 145.43 16.12 Favored Glycine 0 N--CA 1.438 -1.175 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.967 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3583 ' ' ARG . . . . . 0.473 ' HE ' ' CG ' ' A' 3587 ' ' ASP . 45.6 mtm180 -71.69 -34.46 69.67 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.697 0.76 . . . . 0.0 109.962 178.621 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.542 ' O ' HG23 ' A' 3588 ' ' VAL . 14.5 t70 -133.35 165.97 23.61 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.192 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3585 ' ' GLN . . . . . 0.416 ' O ' HG23 ' A' 3589 ' ' VAL . 36.2 tt0 -53.82 -37.46 63.59 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.069 0.461 . . . . 0.0 110.299 176.603 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -65.99 -44.8 83.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.279 176.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.504 ' HB3' ' H ' ' A' 3584 ' ' ASP . 14.8 t70 -64.46 -41.02 96.76 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.633 -177.445 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' 3584 ' ' ASP . 88.7 t -56.93 -48.0 82.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.321 178.183 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3589 ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' 3585 ' ' GLN . 88.9 t -59.0 -47.34 90.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.391 178.38 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 22.4 t -62.53 -41.59 98.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.006 -179.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -67.95 -38.26 82.59 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 122.318 -0.239 . . . . 0.0 110.761 178.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3592 ' ' THR . . . . . 0.528 HG22 ' HE2' ' A' 3596 ' ' LYS . 44.9 m -62.6 -52.24 64.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.702 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.6 pt-20 -62.71 -41.76 99.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.619 0.247 . . . . 0.0 111.146 -178.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.5 m -61.23 -46.64 89.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.852 0.358 . . . . 0.0 110.572 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.588 HD12 ' HB2' ' A' 3599 ' ' PHE . 50.3 tp -63.48 -42.55 98.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.762 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.562 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 57.7 mtmt -62.53 -45.53 92.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.506 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.03 -33.32 59.63 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.27 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.513 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -93.94 -46.65 7.07 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -172.039 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.724 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 21.4 m-85 -100.55 -50.93 3.74 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -176.214 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.562 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.0 mm -61.51 -60.9 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.276 -174.243 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 60.8 m -59.4 -40.59 87.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.3 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.724 ' HD2' ' HA ' ' A' 3599 ' ' PHE . 0.0 OUTLIER -65.04 -50.38 66.45 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.838 0.351 . . . . 0.0 110.835 -179.726 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.703 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -70.36 -36.05 73.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.911 -170.528 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -75.78 -29.17 58.68 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.942 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.31 -40.34 77.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.122 0.486 . . . . 0.0 110.175 176.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -73.46 -19.1 61.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.266 177.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3607 ' ' GLN . . . . . 0.446 ' O ' ' HG ' ' A' 3555 ' ' LEU . 46.4 mt-30 46.97 58.31 4.89 Favored 'General case' 0 C--O 1.232 0.161 0 O-C-N 123.815 0.697 . . . . 0.0 109.139 -168.375 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.425 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -140.88 174.59 10.37 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.38 0.61 . . . . 0.0 112.214 -172.194 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.743 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -108.28 117.54 34.43 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.453 174.26 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -65.34 103.73 0.85 Allowed Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 176.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.714 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 29.8 mm -89.32 123.37 41.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 121.374 0.607 . . . . 0.0 110.902 -174.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.671 HD13 ' HB3' ' A' 3547 ' ' LEU . 48.0 mt -120.82 111.92 33.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.179 174.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 6.6 m120 -88.84 136.18 33.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.872 -175.062 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.502 ' HB ' ' HB2' ' A' 3624 ' ' TYR . 46.1 t . . . . . 0 C--N 1.321 -0.636 0 CA-C-O 120.766 0.317 . . . . 0.0 110.193 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.502 ' HB2' ' HB ' ' A' 3614 ' ' VAL . 64.6 m-85 . . . . . 0 CA--C 1.517 -0.313 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.421 HG13 HD12 ' A' 3611 ' ' ILE . 2.9 t -130.68 116.65 35.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.79 175.084 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.6 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -100.84 113.79 27.04 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 170.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.528 ' O ' ' HA ' ' A' 3659 ' ' ILE . 78.5 mt-30 -94.41 111.09 22.83 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.715 -178.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.596 HG12 HG12 ' A' 3659 ' ' ILE . 44.9 mt -92.24 98.62 8.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-O 121.024 0.44 . . . . 0.0 110.181 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3629 ' ' PHE . . . . . 0.437 ' CE1' ' HB2' ' A' 3609 ' ' ALA . 84.1 m-85 -89.42 141.21 28.71 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.973 178.389 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.487 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 39.8 Cg_endo -67.05 172.93 9.14 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.583 2.188 . . . . 0.0 111.077 176.047 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -68.95 41.85 0.28 Allowed 'Trans proline' 0 CA--C 1.535 0.57 0 C-N-CA 122.739 2.293 . . . . 0.0 112.724 175.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3632 ' ' CYS . . . . . 0.502 ' O ' ' HG2' ' A' 3636 ' ' GLU . 27.0 p -77.4 162.1 27.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.726 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -54.9 -35.23 63.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.303 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 28.6 t80 -53.9 -52.33 60.87 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.004 0.43 . . . . 0.0 110.601 176.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 7.1 m -62.46 -56.64 16.25 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.654 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3636 ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.5 mm-40 -58.3 -43.05 87.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.869 -172.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 35.6 p -62.8 -47.91 81.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.055 0.455 . . . . 0.0 110.754 -178.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 69.4 m80 -66.9 -34.76 78.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.436 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3639 ' ' LEU . . . . . 0.435 HD23 HG11 ' A' 3527 ' ' VAL . 82.1 mt -63.48 -32.85 74.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.841 175.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.688 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 19.3 m -69.44 -33.8 73.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.198 0.523 . . . . 0.0 110.399 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -84.13 -34.52 24.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.337 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.753 HD13 HD22 ' A' 3575 ' ' LEU . 19.3 mt -93.73 -24.56 17.78 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -172.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -154.54 75.0 5.83 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.628 0.251 . . . . 0.0 111.388 178.61 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.77 -24.9 61.24 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.599 2.199 . . . . 0.0 113.417 -175.155 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 10.0 t70 -75.78 -55.15 5.91 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.589 ' HB3' ' CE1' ' A' 3505 ' ' TYR . 0.1 OUTLIER -68.13 -30.57 69.75 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 179.858 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.688 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -53.96 -47.63 71.12 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.217 176.261 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -65.55 -19.07 65.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.874 0.368 . . . . 0.0 111.189 -178.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 70.8 m -87.74 -35.35 17.96 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.872 176.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.632 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.1 pt -79.94 -15.21 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.063 -178.102 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 49.0 m -61.92 -20.36 63.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.085 0.469 . . . . 0.0 110.181 175.042 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -88.31 -38.12 15.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.27 173.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.632 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -104.42 44.07 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 122.508 1.147 . . . . 0.0 108.853 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.467 ' N ' ' HD2' ' A' 3655 ' ' PRO . 16.1 m -32.62 -47.69 0.51 Allowed Pre-proline 0 N--CA 1.468 0.435 0 CA-C-N 113.624 -1.625 . . . . 0.0 113.174 171.122 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.497 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.7 Cg_endo -59.08 88.71 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.605 1.537 . . . . 0.0 111.9 170.694 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -154.66 169.64 23.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.369 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.458 ' HB3' HG23 ' A' 3628 ' ' ILE . 56.9 mt -121.88 133.71 54.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.371 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.7 tmm? -100.38 111.65 23.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.833 HD12 HD21 ' A' 3524 ' ' LEU . 75.9 mt -106.36 120.27 57.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.59 -170.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.684 HG13 ' HD2' ' A' 3573 ' ' TYR . 87.9 t -103.76 114.83 44.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.884 -178.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.651 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 69.7 mt -91.15 120.17 39.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.059 177.659 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -116.62 126.27 53.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.658 0.266 . . . . 0.0 110.763 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 23.4 p -96.91 122.85 40.34 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.282 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 33.8 t . . . . . 0 C--O 1.251 1.181 0 O-C-N 123.561 0.538 . . . . 0.0 110.983 178.531 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.594 ' CD2' ' HB2' ' A' 3553 ' ' MET . 7.2 m-85 . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 111.454 0.168 . . . . 0.0 111.454 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.847 ' HG2' ' H ' ' B' 2520 ' ' THR . 54.6 tt0 56.97 -150.11 0.45 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.316 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.847 ' H ' ' HG2' ' B' 2519 ' ' GLU . 5.9 t -167.32 132.34 1.99 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 175.156 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.736 HD12 HH11 ' A' 3552 ' ' ARG . 1.4 tp . . . . . 0 N--CA 1.449 -0.509 0 C-N-CA 120.415 -0.514 . . . . 0.0 110.019 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.552 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 113.33 0.863 . . . . 0.0 113.33 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.705 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -69.22 -15.31 63.35 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.501 -173.798 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.61 ' N ' HD13 ' A' 3502 ' ' LEU . 52.2 tptt -68.71 -24.0 64.43 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.541 176.745 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3504 ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 60.6 mmtt -100.32 -43.03 6.4 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.037 174.622 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.708 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -149.16 104.07 3.34 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.637 -179.104 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 3506 ' ' PRO . . . . . 0.705 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 84.5 Cg_endo -84.51 173.97 8.16 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 123.988 3.125 . . . . 0.0 113.938 -174.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.414 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 86.4 mt -71.83 133.42 31.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.915 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 26.9 m -100.94 -30.59 3.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.51 -178.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.636 ' CB ' HD13 ' A' 3538 ' ' LEU . 34.1 t-105 -150.23 149.72 30.57 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -143.77 119.35 10.4 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -174.48 -127.46 1.01 Allowed Glycine 0 N--CA 1.443 -0.853 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 -177.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.629 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -138.96 158.5 44.09 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.176 0.512 . . . . 0.0 111.124 177.533 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.494 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.7 mt -108.93 148.88 30.01 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 168.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.717 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -142.85 129.33 20.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.848 0.356 . . . . 0.0 111.182 -179.076 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.631 HD12 HD21 ' B' 2521 ' ' LEU . 0.2 OUTLIER -137.32 138.15 39.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 171.655 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.619 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.1 OUTLIER 63.94 -93.96 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -168.693 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -144.28 10.25 1.47 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.353 173.28 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.472 ' O ' ' HA ' ' A' 3514 ' ' ALA . 8.8 m-20 -86.72 132.98 33.71 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.218 -177.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 24.7 p -122.5 129.86 52.43 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.324 0.583 . . . . 0.0 111.945 -175.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -130.71 115.03 16.12 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.075 173.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.629 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.74 125.11 25.93 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.478 HG21 ' HG ' ' A' 3513 ' ' LEU . 35.0 m -130.91 149.53 33.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.585 0.707 . . . . 0.0 111.972 -174.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -113.0 124.09 51.84 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.304 170.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.796 HD21 HD12 ' A' 3659 ' ' ILE . 0.8 OUTLIER -94.01 111.21 22.9 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.636 -174.319 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.414 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 79.4 m-70 -88.72 136.34 33.05 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.981 -1.008 . . . . 0.0 108.928 177.391 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.708 ' O ' ' HB2' ' A' 3505 ' ' TYR . 61.0 t80 -67.6 138.31 56.33 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.566 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.9 t -114.59 -56.67 4.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.243 0.544 . . . . 0.0 110.812 176.111 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.453 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 61.4 m -160.52 171.4 19.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.91 -171.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.19 -152.77 23.01 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.8 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.504 ' HB2' ' HA ' ' A' 3571 ' ' THR . 48.1 t-20 -91.97 111.3 22.78 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -177.668 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -64.26 -33.21 75.3 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.929 0.395 . . . . 0.0 110.788 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 60.6 t -62.52 -30.34 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.294 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.564 HD23 ' HD3' ' A' 3536 ' ' ARG . 15.8 mt -59.47 -41.42 89.72 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.354 178.271 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -68.96 -41.35 78.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.986 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 80.7 t60 -63.69 -33.64 76.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.111 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.564 ' HD3' HD23 ' A' 3533 ' ' LEU . 14.4 ptm180 -89.92 -11.73 40.94 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.225 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.47 ' O ' HG11 ' A' 3614 ' ' VAL . 47.5 p -103.7 -38.28 7.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.728 0.299 . . . . 0.0 111.522 -179.163 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.636 HD13 ' CB ' ' A' 3509 ' ' TRP . 20.3 mt -81.42 110.11 17.34 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.955 0.407 . . . . 0.0 110.005 -176.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3539 ' ' PRO . . . . . 0.417 ' HD3' ' O ' ' A' 3537 ' ' SER . 58.6 Cg_endo . . . . . 0 N--CA 1.46 -0.466 0 C-N-CA 122.936 2.424 . . . . 0.0 113.03 -175.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo . . . . . 0 C--O 1.236 0.408 0 CA-C-O 120.915 0.298 . . . . 0.0 112.68 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.718 ' HB3' HD13 ' A' 3612 ' ' ILE . 22.5 mt -67.7 113.91 5.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.63 179.12 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.717 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -96.62 138.16 34.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.133 0.492 . . . . 0.0 112.028 -172.061 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.412 ' HB ' ' HB2' ' A' 3515 ' ' LEU . 19.4 mt -95.98 107.57 19.89 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-O 122.236 1.017 . . . . 0.0 111.694 -172.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.439 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.93 -2.61 13.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.054 -173.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.665 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 69.4 mt-30 -146.81 176.72 9.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.359 0.123 . . . . 0.0 110.872 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.8 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.45 140.58 12.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.952 0.406 . . . . 0.0 111.604 179.285 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.585 ' HB2' ' CD2' ' B' 2518 ' ' TYR . 14.8 tmm? -109.71 122.8 48.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.174 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3554 ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' 3554 ' ' ARG . 8.5 mmm180 -69.88 110.07 4.8 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 -177.081 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.517 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -73.52 98.3 2.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.281 1.039 . . . . 0.0 109.524 -177.315 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.616 ' O ' ' HG ' ' A' 3560 ' ' LEU . 34.2 mt-10 -111.49 171.67 7.34 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.67 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -57.54 -51.34 69.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.843 0.354 . . . . 0.0 111.041 -179.558 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 36.1 p -65.91 -32.81 74.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.387 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.583 ' O ' HG23 ' A' 3563 ' ' VAL . 12.1 mm100 -71.53 -40.54 70.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.093 179.252 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' 3556 ' ' GLU . 84.8 mt -60.06 -34.27 73.2 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.019 0.437 . . . . 0.0 110.109 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' 3557 ' ' ALA . 17.5 mm-40 -60.9 -49.74 76.24 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.119 173.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -65.02 -30.2 77.37 Favored Glycine 0 CA--C 1.52 0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.771 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.596 ' O ' ' HG3' ' A' 3567 ' ' MET . 59.8 t -66.71 -53.87 30.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 174.917 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3564 ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.22 -31.06 68.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.594 178.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -53.08 -51.82 60.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.691 176.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3566 ' ' ARG . . . . . 0.447 HH11 ' HD3' ' A' 3566 ' ' ARG . 14.0 ptt-85 -83.04 -9.28 59.33 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.093 0.473 . . . . 0.0 111.046 -178.266 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.596 ' HG3' ' O ' ' A' 3563 ' ' VAL . 81.2 mtp -84.5 -22.72 30.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.812 178.54 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 43.5 p -77.42 -5.73 50.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.035 0.445 . . . . 0.0 110.988 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 20.5 t -119.34 78.7 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.798 175.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.0 108.85 1.93 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.66 176.431 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.504 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 1.8 m 153.05 -41.73 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 O-C-N 124.921 1.388 . . . . 0.0 108.346 -176.117 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -84.96 -26.23 27.3 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.641 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.685 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -124.93 164.81 19.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.757 177.834 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.673 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 33.7 t -127.49 136.61 52.0 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 172.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.715 HD22 HD13 ' A' 3642 ' ' LEU . 13.0 tp -105.73 125.12 50.61 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.175 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.647 HD11 HD11 ' A' 3661 ' ' ILE . 67.7 mt -126.85 155.24 43.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.115 0.483 . . . . 0.0 111.035 -177.24 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.71 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -123.79 107.19 11.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.203 179.257 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.474 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.35 122.61 37.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.527 0.679 . . . . 0.0 110.488 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.504 HD21 HG22 ' A' 3650 ' ' ILE . 68.8 mt -122.88 147.58 51.53 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.658 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3580 ' ' PRO . . . . . 0.466 ' HA ' ' O ' ' A' 3521 ' ' ALA . 13.8 Cg_endo -57.42 125.47 18.93 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 122.096 1.864 . . . . 0.0 111.829 176.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 29.8 p -107.61 119.19 38.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.308 0.575 . . . . 0.0 110.164 178.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.49 146.08 16.13 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.769 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3583 ' ' ARG . . . . . 0.432 ' HG3' ' OD2' ' A' 3587 ' ' ASP . 35.6 mtp180 -69.97 -20.53 63.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.7 0.762 . . . . 0.0 108.946 173.92 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.599 ' O ' HG23 ' A' 3588 ' ' VAL . 9.7 t70 -154.26 169.55 23.39 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.553 -1.203 . . . . 0.0 107.876 -178.171 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -56.69 -44.69 81.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 118.165 0.439 . . . . 0.0 110.905 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.72 -35.51 80.8 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.484 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.457 ' HB3' ' H ' ' A' 3584 ' ' ASP . 20.3 t70 -68.02 -40.72 82.9 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.194 -178.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' 3584 ' ' ASP . 73.9 t -56.12 -45.15 80.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.511 177.023 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 85.6 t -55.78 -46.96 80.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.786 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 28.7 t -65.28 -43.79 90.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.026 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -64.24 -37.28 86.91 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.49 179.028 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 90.1 m -60.95 -54.96 38.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.612 177.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -65.54 -36.0 82.52 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.276 -177.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 20.9 t -65.32 -44.42 87.86 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.511 HD12 ' HB2' ' A' 3599 ' ' PHE . 58.7 tp -64.66 -45.96 84.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.119 -178.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.795 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.62 -29.3 69.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.324 -176.42 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -85.6 -41.05 15.59 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.245 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -86.87 -46.36 9.99 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -171.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.511 ' HB2' HD12 ' A' 3595 ' ' LEU . 11.2 m-85 -98.91 -50.74 4.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.806 0.336 . . . . 0.0 111.212 -175.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.795 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 24.8 mm -59.8 -54.55 33.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.978 -176.313 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3601 ' ' THR . . . . . 0.463 ' O ' ' HG3' ' A' 3604 ' ' GLN . 59.2 m -62.42 -38.4 89.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.431 -178.252 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 43.0 t80 -72.05 -54.32 10.2 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.116 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.532 HD12 ' O ' ' A' 3608 ' ' ALA . 0.4 OUTLIER -57.01 -38.78 73.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.794 179.85 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 3604 ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' 3601 ' ' THR . 4.7 pp0? -72.29 -34.64 68.32 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.149 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -64.86 -36.98 86.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.874 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -84.1 -18.14 37.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.119 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 51.21 55.38 9.58 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -169.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.552 ' HB1' ' HB2' ' A' 3552 ' ' ARG . . . -135.21 -177.63 4.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.256 0.551 . . . . 0.0 112.113 -173.01 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.8 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.65 117.46 28.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.672 175.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -62.81 104.48 0.8 Allowed Glycine 0 C--O 1.224 -0.517 0 C-N-CA 120.751 -0.738 . . . . 0.0 111.365 178.394 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.665 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.5 mm -89.86 124.01 42.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.322 0.582 . . . . 0.0 110.884 -174.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.718 HD13 ' HB3' ' A' 3547 ' ' LEU . 45.7 mt -119.78 108.66 24.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.607 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.412 ' HA ' ' O ' ' A' 3624 ' ' TYR . 87.2 m-20 -85.22 121.17 27.58 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.67 -176.233 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3614 ' ' VAL . . . . . 0.47 HG11 ' O ' ' A' 3537 ' ' SER . 48.4 t . . . . . 0 C--N 1.322 -0.591 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.983 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.461 ' HB2' ' HB ' ' A' 3614 ' ' VAL . 60.0 m-85 . . . . . 0 CA--C 1.512 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.487 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.497 HG13 HD12 ' A' 3611 ' ' ILE . 4.1 t -126.05 113.89 36.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.095 177.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.4 mp -98.84 112.46 24.55 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.479 ' O ' ' HA ' ' A' 3659 ' ' ILE . 33.9 mt-30 -95.14 111.15 23.01 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.9 -176.494 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.574 HG12 HG12 ' A' 3659 ' ' ILE . 39.9 mt -93.12 99.12 9.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.628 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -89.71 145.21 33.04 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.005 178.371 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.32 169.37 18.5 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.427 2.085 . . . . 0.0 111.243 173.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3631 ' ' PRO . . . . . 0.425 ' HD3' HD12 ' A' 3600 ' ' ILE . 57.0 Cg_endo -71.08 48.23 0.85 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.185 2.59 . . . . 0.0 112.576 178.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.9 p -74.72 163.4 27.73 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.374 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -47.43 -47.56 26.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.71 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 30.1 t80 -47.06 -48.11 22.52 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.414 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 20.6 t -59.26 -58.8 7.06 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.978 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -66.76 -35.22 79.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.336 -171.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 62.0 m -58.18 -57.77 11.39 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 120.867 0.365 . . . . 0.0 110.725 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3638 ' ' HIS . . . . . 0.491 ' CE1' HD11 ' A' 3575 ' ' LEU . 10.2 p80 -69.42 -26.14 64.47 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 120.145 -0.622 . . . . 0.0 110.721 -177.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 50.2 mt -64.42 -35.27 80.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.843 0.354 . . . . 0.0 110.375 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.948 ' HA ' HD22 ' A' 3647 ' ' LEU . 16.6 m -67.78 -39.01 84.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.232 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -78.18 -24.06 47.34 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.491 -177.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.715 HD13 HD22 ' A' 3575 ' ' LEU . 17.4 mt -101.13 -41.0 6.91 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -172.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.514 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -147.09 89.11 5.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.751 0.31 . . . . 0.0 111.687 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3644 ' ' PRO . . . . . 0.434 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 85.6 Cg_endo -78.14 -16.78 13.82 Favored 'Trans proline' 0 CA--C 1.534 0.475 0 C-N-CA 122.608 2.205 . . . . 0.0 113.974 -175.034 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 6.8 t0 -76.08 -53.4 8.39 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -177.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.71 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -73.13 -28.02 62.01 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 179.82 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.948 HD22 ' HA ' ' A' 3640 ' ' SER . 24.3 tp -52.15 -52.88 49.08 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.061 0.458 . . . . 0.0 111.04 175.328 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.23 -17.95 63.01 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.254 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 11.0 m -87.39 -37.34 17.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.474 178.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.602 ' HA ' HG22 ' A' 3653 ' ' ILE . 3.5 pt -79.4 -12.13 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.863 0.363 . . . . 0.0 111.392 -178.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 19.7 m -55.05 -37.97 67.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.485 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 8.8 t30 -80.16 -33.5 38.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.841 0.353 . . . . 0.0 110.743 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.602 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.6 tp -104.01 39.67 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 122.585 1.184 . . . . 0.0 109.279 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.439 ' N ' ' HD2' ' A' 3655 ' ' PRO . 47.0 t -33.92 -46.03 0.63 Allowed Pre-proline 0 CA--C 1.541 0.604 0 CA-C-N 113.582 -1.644 . . . . 0.0 113.286 169.617 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.463 ' HG2' HD12 ' A' 3653 ' ' ILE . 19.8 Cg_endo -61.17 79.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.519 1.479 . . . . 0.0 111.776 170.482 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3656 ' ' HIS . . . . . 0.404 ' HB2' HD23 ' A' 3579 ' ' LEU . 31.5 p80 -143.78 170.31 16.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.999 -178.047 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.471 HD22 HG22 ' A' 3628 ' ' ILE . 69.2 mt -115.38 143.38 45.37 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.526 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 8.7 tmm? -110.48 111.26 22.39 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 177.227 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.796 HD12 HD21 ' A' 3524 ' ' LEU . 70.3 mt -107.95 122.52 62.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.652 -170.304 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.685 HG13 ' HD2' ' A' 3573 ' ' TYR . 72.3 t -106.27 116.47 50.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.005 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.673 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 54.0 mt -91.0 113.12 26.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.213 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.81 128.92 56.26 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.107 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 13.7 m -76.14 132.12 39.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.955 174.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.441 -0.79 . . . . 0.0 109.696 175.677 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.585 ' CD2' ' HB2' ' A' 3553 ' ' MET . 13.2 m-85 . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 120.36 0.124 . . . . 0.0 111.238 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.682 ' HG2' ' H ' ' B' 2520 ' ' THR . 14.5 tt0 55.09 -157.28 0.22 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.682 ' H ' ' HG2' ' B' 2519 ' ' GLU . 85.3 m -155.53 121.26 5.01 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 174.215 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.71 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.411 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.713 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.567 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp . . . . . 0 N--CA 1.455 -0.201 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.614 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.17 -15.68 62.98 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.239 -173.852 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.614 ' N ' HD13 ' A' 3502 ' ' LEU . 49.6 tptt -67.05 -30.58 70.69 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 177.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 17.1 tptm -96.37 -39.68 9.49 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.399 178.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.688 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -151.4 106.97 2.94 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 121.454 0.645 . . . . 0.0 111.148 178.756 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 3506 ' ' PRO . . . . . 0.546 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 97.5 Cg_endo -86.35 174.41 6.05 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 124.184 3.256 . . . . 0.0 113.937 -177.747 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.507 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 94.4 mt -71.4 135.41 28.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.259 -178.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.521 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.4 m -102.46 -29.9 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.325 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.65 ' HB2' HD13 ' A' 3538 ' ' LEU . 39.9 t-105 -150.07 154.66 38.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.286 -178.32 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -150.52 119.14 6.51 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.009 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.3 -125.06 0.78 Allowed Glycine 0 N--CA 1.443 -0.881 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 -176.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.655 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.5 mp -141.44 158.57 43.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.087 0.47 . . . . 0.0 111.178 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.476 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 81.8 mt -113.24 150.25 32.64 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 169.152 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.591 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.21 125.62 13.97 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -177.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.596 HD12 HD21 ' B' 2521 ' ' LEU . 0.2 OUTLIER -138.39 138.71 38.5 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 171.944 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.553 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.3 OUTLIER 59.97 -96.31 0.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.537 0.523 . . . . 0.0 110.122 -170.644 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -138.06 9.33 2.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.579 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.41 ' O ' ' HA ' ' A' 3514 ' ' ALA . 27.5 m-20 -100.28 125.71 46.51 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.857 -177.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' 3514 ' ' ALA . 38.6 p -117.73 134.83 54.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.563 177.726 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -129.86 122.51 28.81 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.655 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.67 119.42 17.87 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.076 0.465 . . . . 0.0 110.133 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.428 HG21 ' HG ' ' A' 3513 ' ' LEU . 35.0 m -130.44 147.98 33.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.596 0.712 . . . . 0.0 112.061 -175.55 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -108.89 126.02 52.62 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.043 172.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.825 HD21 HD12 ' A' 3659 ' ' ILE . 1.2 mt -94.83 110.31 22.19 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.736 -176.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.507 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 79.2 m-70 -86.71 138.96 31.21 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.03 -0.986 . . . . 0.0 108.878 176.166 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.688 ' O ' ' HB2' ' A' 3505 ' ' TYR . 69.1 t80 -68.99 137.91 54.1 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 173.589 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.584 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.3 t -114.61 -56.51 4.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 CA-C-O 121.474 0.654 . . . . 0.0 110.664 176.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.439 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 73.8 m -160.83 171.84 18.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.997 -172.081 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 90.12 -150.95 21.25 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.897 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.549 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.7 t-20 -101.53 111.73 24.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.955 0.407 . . . . 0.0 111.099 -177.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.2 p30 -62.31 -30.67 71.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.482 -177.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3532 ' ' VAL . . . . . 0.565 ' O ' ' HG2' ' A' 3536 ' ' ARG . 62.1 t -61.08 -35.57 66.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.491 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.434 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 29.7 mt -55.98 -40.45 73.31 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.929 177.622 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.405 ' HB1' ' CD1' ' A' 3538 ' ' LEU . . . -70.19 -37.14 75.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.994 0.426 . . . . 0.0 110.693 -179.504 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -61.5 -39.34 90.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.892 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.565 ' HG2' ' O ' ' A' 3532 ' ' VAL . 12.5 ptp180 -88.7 -21.39 23.91 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -177.196 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.527 ' HB2' HD11 ' A' 3626 ' ' LEU . 58.0 p -90.17 -43.31 10.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.71 0.291 . . . . 0.0 111.508 -178.268 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.65 HD13 ' HB2' ' A' 3509 ' ' TRP . 25.2 mt -78.65 113.59 36.14 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -174.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo . . . . . 0 N--CA 1.461 -0.392 0 C-N-CA 123.174 2.583 . . . . 0.0 113.258 -170.803 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 3546 ' ' PRO . . . . . 0.638 ' HA ' ' O ' ' A' 3512 ' ' LEU . 93.2 Cg_endo . . . . . 0 N--CA 1.451 -0.974 0 CA-C-O 120.926 0.302 . . . . 0.0 112.232 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.676 ' HB3' HD13 ' A' 3612 ' ' ILE . 28.6 mt -69.24 113.22 6.39 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.795 175.509 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.591 ' HA ' ' O ' ' A' 3514 ' ' ALA . 40.4 ptt85 -91.41 135.76 33.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.936 0.398 . . . . 0.0 110.842 -175.12 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.677 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.2 mt -91.61 107.87 19.31 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-O 122.211 1.005 . . . . 0.0 111.021 -177.66 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.478 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -115.21 2.32 14.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.179 -0.918 . . . . 0.0 111.562 -175.012 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.698 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 73.9 mt-30 -151.54 171.94 16.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.581 0.229 . . . . 0.0 110.98 178.472 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.696 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.28 138.34 16.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.013 0.435 . . . . 0.0 111.322 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.718 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 17.9 ttt -109.49 124.88 51.81 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.467 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -65.75 110.79 2.94 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.37 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.57 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -75.13 97.95 3.58 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 122.32 1.057 . . . . 0.0 108.965 178.101 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.664 ' HB2' ' HG2' ' A' 3559 ' ' GLN . 58.2 mm-40 -113.18 165.43 12.41 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.821 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.498 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.31 -51.87 65.31 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.319 0.387 . . . . 0.0 111.098 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 41.5 p -62.09 -33.15 73.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.073 0.463 . . . . 0.0 110.908 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.664 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 32.1 mm-40 -73.88 -44.43 55.35 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.047 -176.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.542 HD21 ' HB2' ' A' 3555 ' ' LEU . 83.0 mt -64.11 -32.56 74.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.254 -176.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' 3557 ' ' ALA . 8.0 mm-40 -69.23 -44.02 72.84 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3562 ' ' GLY . . . . . 0.417 ' O ' ' HB3' ' A' 3565 ' ' ARG . . . -59.49 -40.03 95.7 Favored Glycine 0 CA--C 1.52 0.357 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.312 176.512 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' 3559 ' ' GLN . 62.7 t -62.51 -48.02 90.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 175.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3564 ' ' ALA . . . . . 0.538 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.44 -32.3 70.08 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.113 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.503 ' O ' HG22 ' A' 3568 ' ' THR . 43.4 ttm180 -57.82 -46.26 84.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.81 177.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -87.05 -5.32 59.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.936 0.398 . . . . 0.0 111.297 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.538 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 82.5 mtp -88.65 -21.12 24.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.959 176.167 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3568 ' ' THR . . . . . 0.503 HG22 ' O ' ' A' 3565 ' ' ARG . 3.3 t -74.59 -14.34 60.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.84 0.352 . . . . 0.0 111.186 -174.268 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 99.2 t -114.4 101.98 13.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.113 0.482 . . . . 0.0 110.412 178.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -73.99 108.32 6.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.549 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.5 m 151.47 -39.96 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.45 1.5 . . . . 0.0 108.082 -174.665 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -82.46 -26.37 32.71 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.523 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.732 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -135.36 169.06 18.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.294 179.061 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.62 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 34.5 t -130.1 136.56 49.46 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 171.726 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.781 HD22 HD13 ' A' 3642 ' ' LEU . 13.1 tp -106.54 125.98 51.69 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.667 HD11 HD11 ' A' 3661 ' ' ILE . 79.5 mt -127.53 157.05 41.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.175 0.512 . . . . 0.0 111.022 -177.667 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.616 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -124.03 109.43 13.51 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.173 179.079 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.472 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -95.1 123.36 38.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.277 0.561 . . . . 0.0 110.584 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.452 ' HG ' HD12 ' A' 3577 ' ' LEU . 69.0 mt -124.02 144.83 46.25 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.09 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.83 112.51 1.66 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.402 2.068 . . . . 0.0 111.955 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.9 p -96.74 108.31 20.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.222 0.534 . . . . 0.0 110.657 -177.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.06 146.79 16.67 Favored Glycine 0 N--CA 1.442 -0.93 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.059 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3583 ' ' ARG . . . . . 0.402 ' HG2' ' H ' ' A' 3583 ' ' ARG . 13.5 mmt180 -68.31 -36.68 79.68 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.682 0.753 . . . . 0.0 109.46 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.639 ' O ' HG23 ' A' 3588 ' ' VAL . 17.1 t70 -129.72 164.71 23.4 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.311 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3585 ' ' GLN . . . . . 0.44 ' O ' HG23 ' A' 3589 ' ' VAL . 23.7 tp60 -56.61 -39.39 73.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.887 0.375 . . . . 0.0 110.374 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -64.58 -44.89 89.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.144 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.49 ' HB3' ' H ' ' A' 3584 ' ' ASP . 30.0 t70 -60.59 -43.16 97.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.308 178.553 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.639 HG23 ' O ' ' A' 3584 ' ' ASP . 98.4 t -56.04 -47.99 79.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.215 177.764 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3589 ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' 3585 ' ' GLN . 80.4 t -60.06 -47.23 92.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.293 178.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 42.3 t -60.73 -42.06 96.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.061 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -69.55 -36.06 76.0 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.001 -0.279 . . . . 0.0 110.661 177.406 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 85.6 m -62.25 -53.17 58.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.697 178.023 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' 3596 ' ' LYS . 11.9 pt-20 -63.57 -34.15 77.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.18 -178.654 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.6 m -69.35 -46.12 67.77 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.884 0.374 . . . . 0.0 110.259 177.15 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.592 HD12 ' HB2' ' A' 3599 ' ' PHE . 63.9 tp -64.36 -43.55 94.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.958 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.811 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.1 OUTLIER -66.3 -32.87 74.54 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.958 -177.002 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.56 -37.58 22.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.795 0.331 . . . . 0.0 111.404 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.565 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -88.95 -45.91 9.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -172.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.72 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 19.7 m-85 -99.73 -50.08 4.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.671 0.272 . . . . 0.0 111.542 -176.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.811 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 24.0 mm -62.04 -60.28 2.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.131 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 91.2 m -56.96 -42.44 80.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.147 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.72 ' HD2' ' HA ' ' A' 3599 ' ' PHE . 0.0 OUTLIER -63.52 -53.37 52.99 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.542 0.211 . . . . 0.0 110.826 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.709 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -66.73 -36.22 81.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.916 0.389 . . . . 0.0 110.916 -170.916 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -73.87 -36.35 64.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.075 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -71.46 -34.56 70.32 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.786 0.327 . . . . 0.0 110.911 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3606 ' ' LYS . . . . . 0.586 ' HG2' ' O ' ' A' 3602 ' ' TYR . 66.5 mmtt -73.92 -18.17 60.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 177.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3607 ' ' GLN . . . . . 0.501 ' O ' ' HG ' ' A' 3555 ' ' LEU . 91.5 mt-30 55.05 43.61 29.44 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -172.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.578 ' HB1' ' HB2' ' A' 3552 ' ' ARG . . . -132.62 172.06 13.02 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.541 -170.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.718 ' HB3' ' HB3' ' A' 3553 ' ' MET . . . -107.95 118.67 37.35 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.354 172.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -63.01 103.6 0.67 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.211 177.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.698 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 32.7 mm -90.01 126.69 42.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 121.188 0.518 . . . . 0.0 110.924 -175.232 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.676 HD13 ' HB3' ' A' 3547 ' ' LEU . 39.7 mt -125.94 115.07 41.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.882 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3613 ' ' ASN . . . . . 0.435 ' HA ' ' O ' ' A' 3624 ' ' TYR . 77.6 m-20 -90.09 119.75 30.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.0 179.351 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 30.2 m . . . . . 0 C--N 1.316 -0.859 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.863 -178.543 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A 3624 ' ' TYR . . . . . 0.512 ' OH ' ' HD3' ' A' 3536 ' ' ARG . 78.9 m-85 . . . . . 0 CA--C 1.511 -0.52 0 CA-C-O 121.031 0.443 . . . . 0.0 110.587 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.455 HG12 ' HG3' ' A' 3627 ' ' GLN . 5.7 t -119.37 114.7 45.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.99 178.501 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -96.27 110.93 23.15 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.307 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.478 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 18.3 mt-30 -94.44 110.43 22.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.826 -178.145 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.578 HG12 HG12 ' A' 3659 ' ' ILE . 35.6 mt -92.14 99.27 9.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.97 141.6 29.68 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.038 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.414 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 40.6 Cg_endo -67.33 165.39 27.07 Favored 'Trans proline' 0 CA--C 1.53 0.309 0 C-N-CA 122.591 2.194 . . . . 0.0 111.233 175.193 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -69.28 77.93 0.87 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.535 2.157 . . . . 0.0 111.876 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3632 ' ' CYS . . . . . 0.435 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.5 p -112.25 163.7 14.07 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.689 -174.745 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3633 ' ' GLU . . . . . 0.521 ' H ' ' CD ' ' A' 3633 ' ' GLU . 1.6 mp0 -46.47 -42.75 15.94 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.545 175.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 42.5 t80 -52.27 -52.12 54.55 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.451 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 55.1 p -69.69 -51.18 36.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.693 -177.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3636 ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' 3632 ' ' CYS . 13.3 mm-40 -60.35 -44.1 95.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.781 0.324 . . . . 0.0 111.361 -175.099 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 37.9 t -63.32 -39.51 94.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.192 0.52 . . . . 0.0 110.456 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 32.3 m80 -73.84 -33.07 63.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.66 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 75.8 mt -68.33 -37.22 80.34 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.407 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.474 ' CA ' ' HG ' ' A' 3647 ' ' LEU . 21.3 p -72.08 -31.1 65.78 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.255 0.55 . . . . 0.0 110.318 176.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3641 ' ' ARG . . . . . 0.489 ' CZ ' ' HA ' ' A' 3641 ' ' ARG . 1.2 tpm_? -76.04 -30.7 58.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.035 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.781 HD13 HD22 ' A' 3575 ' ' LEU . 16.4 mt -103.71 -32.65 9.27 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -172.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.433 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -148.7 72.74 10.59 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -175.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3644 ' ' PRO . . . . . 0.462 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 37.1 Cg_endo -65.57 -22.17 58.69 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 122.494 2.13 . . . . 0.0 111.764 179.341 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3645 ' ' ASP . . . . . 0.415 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 12.1 m-20 -70.1 -45.92 65.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.901 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.616 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -84.95 -30.74 24.04 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.575 176.73 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.474 ' HG ' ' CA ' ' A' 3640 ' ' SER . 3.4 tm? -54.19 -48.65 70.73 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.968 -179.278 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.66 -18.44 59.54 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.845 0.355 . . . . 0.0 111.67 -176.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 6.4 t -89.73 -38.28 13.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.189 179.117 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.588 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.1 pt -76.59 -13.32 14.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -175.638 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.7 m -63.22 -17.65 62.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.953 0.406 . . . . 0.0 110.756 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 8.3 t30 -88.33 -36.71 16.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.171 0.51 . . . . 0.0 109.888 173.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.588 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -104.85 41.93 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-O 122.41 1.1 . . . . 0.0 109.327 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.449 ' N ' ' HD2' ' A' 3655 ' ' PRO . 66.5 m -33.47 -45.7 0.53 Allowed Pre-proline 0 CA--C 1.539 0.536 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.83 170.127 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.513 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.2 Cg_endo -59.4 84.42 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.511 1.474 . . . . 0.0 111.562 169.676 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -150.74 170.93 18.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.434 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.489 HD22 HG22 ' A' 3628 ' ' ILE . 43.8 mt -123.17 136.32 54.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.559 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 14.5 tmm? -102.7 111.81 24.3 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.825 HD12 HD21 ' A' 3524 ' ' LEU . 70.8 mt -107.31 119.74 57.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.276 0.56 . . . . 0.0 111.529 -170.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.732 HG13 ' HD2' ' A' 3573 ' ' TYR . 81.0 t -102.93 116.5 46.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.77 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.667 HD11 HD11 ' A' 3576 ' ' LEU . 55.1 mt -91.05 112.46 25.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 176.016 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -115.16 133.67 55.83 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.433 -177.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.9 m -67.82 110.05 3.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.7 171.104 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.25 1.084 0 C-N-CA 124.679 1.192 . . . . 0.0 112.75 -174.364 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.483 ' CD1' ' HB2' ' A' 3553 ' ' MET . 40.9 m-85 . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 119.833 -0.127 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.568 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.5 OUTLIER 54.54 -163.11 0.12 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.589 0.709 . . . . 0.0 111.948 178.237 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 10.8 p -145.47 116.15 7.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.413 167.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.677 HD22 ' CG2' ' A' 3549 ' ' ILE . 3.1 tp . . . . . 0 CA--C 1.521 -0.167 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.254 -178.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3501 ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp . . . . . 0 CA--C 1.53 0.191 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3502 ' ' LEU . . . . . 0.587 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -68.94 -14.79 63.25 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.339 -174.567 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 3503 ' ' LYS . . . . . 0.587 ' N ' HD13 ' A' 3502 ' ' LEU . 12.2 tmtt? -66.6 -28.99 68.94 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 176.065 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -99.78 -42.88 6.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.356 177.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3505 ' ' TYR . . . . . 0.701 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.17 99.16 3.7 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 121.481 0.657 . . . . 0.0 110.781 -179.703 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 3506 ' ' PRO . . . . . 0.541 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 60.1 Cg_endo -80.29 173.65 12.25 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 123.817 3.011 . . . . 0.0 113.504 -178.173 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3507 ' ' ILE . . . . . 0.487 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 74.8 mt -71.31 135.73 27.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.112 -176.01 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3508 ' ' VAL . . . . . 0.414 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.3 m -101.91 -29.14 3.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.408 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3509 ' ' TRP . . . . . 0.683 ' HB2' HD13 ' A' 3538 ' ' LEU . 74.7 t-105 -151.96 155.11 37.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.641 0.258 . . . . 0.0 110.717 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -148.13 118.93 7.56 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 176.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.86 -130.24 1.15 Allowed Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3512 ' ' LEU . . . . . 0.678 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -139.71 158.05 44.74 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.966 0.412 . . . . 0.0 110.803 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3513 ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' 3519 ' ' THR . 84.1 mt -110.47 149.65 30.0 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 170.017 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3514 ' ' ALA . . . . . 0.644 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.3 120.96 11.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -177.255 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3515 ' ' LEU . . . . . 0.709 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.27 145.75 41.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 172.935 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 3516 ' ' LYS . . . . . 0.709 ' HD3' HD12 ' A' 3515 ' ' LEU . 1.3 mptp? 63.64 -95.79 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -168.633 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -145.27 9.99 1.27 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.681 174.427 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3518 ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' A' 3514 ' ' ALA . 27.3 m-20 -97.28 129.12 44.62 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.423 -174.344 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3519 ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' 3514 ' ' ALA . 31.8 p -117.1 133.58 55.82 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.14 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -126.05 120.85 31.34 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3521 ' ' ALA . . . . . 0.678 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.17 120.64 18.06 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.086 0.47 . . . . 0.0 109.947 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3522 ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' 3579 ' ' LEU . 26.8 m -129.85 147.71 33.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.625 0.726 . . . . 0.0 111.822 -175.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -110.45 124.94 52.7 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.828 173.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3524 ' ' LEU . . . . . 0.796 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -94.17 109.96 21.72 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.597 -175.136 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 3525 ' ' HIS . . . . . 0.487 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 73.4 m-70 -87.58 138.9 31.07 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.747 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3526 ' ' PHE . . . . . 0.701 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.2 t80 -67.56 136.41 54.47 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.355 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3527 ' ' VAL . . . . . 0.581 ' CG1' HD23 ' A' 3575 ' ' LEU . 26.1 t -114.68 -55.39 4.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 121.254 0.549 . . . . 0.0 110.765 176.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3528 ' ' SER . . . . . 0.5 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 72.9 m -162.01 172.53 15.8 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.948 -172.435 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.74 -152.21 22.29 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.338 -0.934 . . . . 0.0 112.166 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3530 ' ' ASN . . . . . 0.573 ' HB2' ' HA ' ' A' 3571 ' ' THR . 50.2 t30 -108.34 119.26 38.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.889 0.376 . . . . 0.0 110.463 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -63.41 -27.5 69.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.691 -177.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3532 ' ' VAL . . . . . 0.405 ' HB ' ' ND2' ' A' 3530 ' ' ASN . 62.4 t -57.86 -32.79 44.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.033 0.444 . . . . 0.0 110.649 178.467 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3533 ' ' LEU . . . . . 0.539 HD23 ' HD3' ' A' 3536 ' ' ARG . 28.3 mt -62.12 -40.61 96.5 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.367 178.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3534 ' ' ALA . . . . . 0.485 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.5 -41.86 92.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.954 0.407 . . . . 0.0 110.195 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -61.03 -37.15 81.58 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.936 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3536 ' ' ARG . . . . . 0.539 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.6 ptm180 -89.78 -7.98 53.18 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.132 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3537 ' ' SER . . . . . 0.496 ' HB2' HD11 ' A' 3626 ' ' LEU . 41.1 p -105.14 -40.5 5.85 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.783 0.325 . . . . 0.0 111.621 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3538 ' ' LEU . . . . . 0.683 HD13 ' HB2' ' A' 3509 ' ' TRP . 28.2 mt -79.14 110.3 14.31 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-O 121.281 0.562 . . . . 0.0 109.708 -173.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo . . . . . 0 N--CA 1.459 -0.542 0 C-N-CA 123.123 2.548 . . . . 0.0 113.273 -170.821 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 3546 ' ' PRO . . . . . 0.583 ' HA ' ' O ' ' A' 3512 ' ' LEU . 87.4 Cg_endo . . . . . 0 N--CA 1.455 -0.756 0 CA-C-O 121.228 0.428 . . . . 0.0 112.733 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3547 ' ' LEU . . . . . 0.672 ' HB3' HD13 ' A' 3612 ' ' ILE . 30.3 mt -85.95 115.24 23.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.131 176.13 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3548 ' ' ARG . . . . . 0.644 ' HA ' ' O ' ' A' 3514 ' ' ALA . 37.7 ptt85 -91.35 140.76 29.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.19 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3549 ' ' ILE . . . . . 0.549 ' CG2' HD22 ' B' 2521 ' ' LEU . 17.3 mt -96.14 107.26 19.45 Favored 'Isoleucine or valine' 0 C--O 1.249 1.045 0 CA-C-O 122.5 1.143 . . . . 0.0 111.458 -177.364 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3550 ' ' ALA . . . . . 0.56 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -114.94 4.63 14.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.92 -172.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3551 ' ' GLN . . . . . 0.731 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 62.6 mt-30 -155.0 167.22 31.08 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.469 0.308 . . . . 0.0 110.804 177.109 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3552 ' ' ARG . . . . . 0.686 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -149.03 134.04 18.11 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.072 0.463 . . . . 0.0 111.228 177.508 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 3553 ' ' MET . . . . . 0.623 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 14.6 tmm? -108.76 116.34 31.79 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.329 178.609 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -65.25 110.24 2.51 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3555 ' ' LEU . . . . . 0.637 ' O ' HD12 ' A' 3555 ' ' LEU . 2.1 pp -69.67 98.71 1.21 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.053 0.93 . . . . 0.0 110.233 -175.345 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3556 ' ' GLU . . . . . 0.627 ' O ' ' HG ' ' A' 3560 ' ' LEU . 37.4 mt-10 -107.67 167.11 10.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.567 177.047 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3557 ' ' ALA . . . . . 0.515 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -57.71 -48.19 80.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.902 0.382 . . . . 0.0 110.238 178.799 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 1.7 p -62.29 -34.01 75.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.715 178.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3559 ' ' GLN . . . . . 0.551 ' O ' HG23 ' A' 3563 ' ' VAL . 86.8 mm-40 -74.38 -40.04 62.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.868 -179.157 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3560 ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' 3556 ' ' GLU . 74.9 mt -63.98 -34.18 77.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.4 179.093 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3561 ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.1 mm-40 -61.71 -45.6 93.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.13 0.49 . . . . 0.0 109.982 174.041 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -58.06 -44.96 94.43 Favored Glycine 0 N--CA 1.453 -0.186 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.214 175.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3563 ' ' VAL . . . . . 0.617 ' O ' ' HG3' ' A' 3567 ' ' MET . 40.2 t -61.83 -50.52 79.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.823 0.344 . . . . 0.0 110.28 177.009 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3564 ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.45 -31.89 68.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.695 -178.556 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3565 ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' 3568 ' ' THR . 31.6 ttp85 -54.3 -46.21 72.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.745 178.221 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3566 ' ' ARG . . . . . 0.428 ' HG2' ' O ' ' A' 3563 ' ' VAL . 16.9 ptt-85 -86.63 -12.74 47.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.872 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3567 ' ' MET . . . . . 0.617 ' HG3' ' O ' ' A' 3563 ' ' VAL . 86.3 mtp -78.25 -27.02 47.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 110.742 178.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3568 ' ' THR . . . . . 0.489 HG22 ' O ' ' A' 3565 ' ' ARG . 7.7 t -82.91 1.34 39.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.197 0.522 . . . . 0.0 110.276 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 51.7 t -128.42 87.41 1.08 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.689 176.19 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -70.4 109.21 4.63 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3571 ' ' THR . . . . . 0.573 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.4 m 151.17 -38.53 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.418 1.487 . . . . 0.0 108.438 -176.404 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -82.36 -29.98 30.62 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.263 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3573 ' ' TYR . . . . . 0.739 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -127.25 163.55 23.68 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.873 176.249 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 3574 ' ' CYS . . . . . 0.614 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 28.0 t -128.25 136.48 51.09 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 171.632 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3575 ' ' LEU . . . . . 0.753 HD22 HD13 ' A' 3642 ' ' LEU . 13.1 tp -106.06 125.61 51.2 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3576 ' ' LEU . . . . . 0.605 HD11 HD11 ' A' 3661 ' ' ILE . 79.7 mt -127.61 155.58 43.63 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.138 0.494 . . . . 0.0 110.825 -177.363 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3577 ' ' LEU . . . . . 0.706 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -123.03 107.9 12.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.387 179.776 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 3578 ' ' ALA . . . . . 0.492 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.27 123.53 37.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.325 0.584 . . . . 0.0 110.501 -177.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3579 ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' 3522 ' ' VAL . 53.6 mt -124.29 144.24 45.13 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 114.97 -1.013 . . . . 0.0 110.328 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3580 ' ' PRO . . . . . 0.406 ' HA ' ' O ' ' A' 3521 ' ' ALA . 18.2 Cg_endo -60.57 113.06 1.53 Allowed 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.37 2.047 . . . . 0.0 111.452 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.2 p -99.28 107.79 20.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.349 0.595 . . . . 0.0 110.362 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3582 ' ' GLY . . . . . 0.439 ' HA2' ' OD2' ' A' 3587 ' ' ASP . . . -98.28 145.6 17.83 Favored Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.563 179.432 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3583 ' ' ARG . . . . . 0.404 ' HG2' ' OD2' ' A' 3587 ' ' ASP . 27.2 mmt-85 -64.4 -43.04 95.67 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3584 ' ' ASP . . . . . 0.612 ' O ' HG23 ' A' 3588 ' ' VAL . 5.3 p-10 -134.65 -179.77 5.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.096 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -57.7 -43.6 85.28 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.102 0.251 . . . . 0.0 111.336 -175.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.33 -43.85 89.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.345 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3587 ' ' ASP . . . . . 0.439 ' OD2' ' HA2' ' A' 3582 ' ' GLY . 26.8 t70 -60.84 -44.67 96.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.398 -179.172 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3588 ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' 3584 ' ' ASP . 98.4 t -56.52 -39.82 64.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.71 178.396 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3589 ' ' VAL . . . . . 0.442 ' O ' ' HG2' ' A' 3593 ' ' GLU . 13.1 t -64.87 -51.1 71.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.582 0.706 . . . . 0.0 109.641 -179.201 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 34.3 m -64.32 -37.99 89.46 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.196 -177.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -71.42 -37.17 71.48 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.128 -0.358 . . . . 0.0 111.061 177.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 89.2 m -63.32 -50.07 71.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.644 0.259 . . . . 0.0 110.818 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3593 ' ' GLU . . . . . 0.547 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 8.8 pt-20 -64.2 -37.11 86.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.97 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 7.6 t -67.52 -43.12 81.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.822 0.344 . . . . 0.0 110.232 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3595 ' ' LEU . . . . . 0.56 HD12 ' HB2' ' A' 3599 ' ' PHE . 61.4 tp -63.42 -46.63 85.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.101 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3596 ' ' LYS . . . . . 0.832 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 57.5 pttt -67.84 -30.58 70.01 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.008 -177.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.78 -38.44 54.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.729 0.299 . . . . 0.0 111.57 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3598 ' ' ALA . . . . . 0.407 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -93.91 -45.93 7.4 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -171.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3599 ' ' PHE . . . . . 0.56 ' HB2' HD12 ' A' 3595 ' ' LEU . 12.0 m-85 -98.97 -50.07 4.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.651 0.262 . . . . 0.0 111.683 -175.014 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3600 ' ' ILE . . . . . 0.832 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.6 mm -61.88 -60.08 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.261 -175.597 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 74.8 m -53.29 -40.92 65.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.675 0.274 . . . . 0.0 111.089 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3602 ' ' TYR . . . . . 0.78 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -64.71 -57.07 9.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.082 179.503 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 3603 ' ' LEU . . . . . 0.78 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.1 OUTLIER -57.99 -41.62 83.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.644 0.259 . . . . 0.0 111.43 -177.89 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -72.66 -36.09 67.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.567 -176.736 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.74 68.44 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.942 0.401 . . . . 0.0 110.961 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -81.2 -19.1 44.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.78 177.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3607 ' ' GLN . . . . . 0.551 ' O ' ' HG ' ' A' 3555 ' ' LEU . 46.3 mt-30 50.39 52.06 15.57 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -171.003 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3608 ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' 3603 ' ' LEU . . . -135.45 -176.19 4.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.193 -171.168 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3609 ' ' ALA . . . . . 0.686 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.4 117.97 29.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.537 176.452 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -65.24 102.4 0.66 Allowed Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.244 -0.742 . . . . 0.0 111.244 177.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3611 ' ' ILE . . . . . 0.731 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 32.4 mm -89.3 126.18 42.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-O 121.201 0.525 . . . . 0.0 110.762 -175.416 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3612 ' ' ILE . . . . . 0.672 HD13 ' HB3' ' A' 3547 ' ' LEU . 34.1 mt -122.07 112.92 36.74 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.221 177.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -84.64 111.7 19.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.121 -179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 C--N 1.321 -0.641 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.662 179.604 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 3624 ' ' TYR . . . . . . . . . . . . . 80.7 m-85 . . . . . 0 N--CA 1.449 -0.49 0 CA-C-O 120.927 0.394 . . . . 0.0 109.962 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A 3625 ' ' VAL . . . . . 0.455 HG13 HG23 ' A' 3611 ' ' ILE . 3.1 t -118.97 115.57 48.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.067 179.262 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3626 ' ' LEU . . . . . 0.629 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -97.82 113.79 25.68 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 169.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3627 ' ' GLN . . . . . 0.575 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 95.0 mt-30 -94.48 111.42 23.17 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.225 -178.26 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3628 ' ' ILE . . . . . 0.595 HG12 HG12 ' A' 3659 ' ' ILE . 40.9 mt -92.08 98.22 8.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.034 178.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -88.96 141.94 29.94 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.855 178.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3630 ' ' PRO . . . . . 0.604 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.6 Cg_endo -70.83 169.24 20.75 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 122.487 2.125 . . . . 0.0 111.414 176.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -68.0 74.31 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.684 2.256 . . . . 0.0 111.833 176.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3632 ' ' CYS . . . . . 0.587 ' O ' ' HG2' ' A' 3636 ' ' GLU . 9.0 p -111.69 163.34 14.23 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.642 -174.431 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -47.69 -41.66 23.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.738 177.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 39.1 t80 -53.91 -52.42 60.59 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.441 177.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 56.4 p -70.29 -53.55 16.38 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.686 -177.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3636 ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.1 mm-40 -56.21 -44.76 79.82 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 123.445 0.466 . . . . 0.0 111.072 -174.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 48.4 t -61.97 -53.11 60.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.565 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 43.2 m80 -61.62 -34.86 76.4 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.573 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.55 -31.3 71.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.315 177.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3640 ' ' SER . . . . . 0.635 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 21.8 m -71.16 -29.91 65.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.33 0.586 . . . . 0.0 110.035 -178.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -89.05 -44.57 10.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.424 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3642 ' ' LEU . . . . . 0.753 HD13 HD22 ' A' 3575 ' ' LEU . 22.8 mt -78.48 -30.85 47.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.246 -0.434 . . . . 0.0 112.17 -173.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3643 ' ' ALA . . . . . 0.459 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -150.78 69.54 8.55 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.456 0.17 . . . . 0.0 111.369 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.0 -19.39 66.4 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.417 2.078 . . . . 0.0 111.731 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3645 ' ' ASP . . . . . 0.447 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 18.1 m-20 -72.83 -51.42 18.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.204 -177.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3646 ' ' LEU . . . . . 0.706 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -79.5 -29.94 41.77 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.183 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 3647 ' ' LEU . . . . . 0.635 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -54.26 -45.72 72.48 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.424 178.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.32 -31.13 69.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.96 0.409 . . . . 0.0 111.119 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 15.3 m -76.78 -36.56 56.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.852 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3650 ' ' ILE . . . . . 0.761 ' HA ' HG22 ' A' 3653 ' ' ILE . 7.0 pt -83.5 -9.89 11.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.925 0.393 . . . . 0.0 111.293 -176.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 8.3 t -60.18 -25.53 65.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.329 176.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 17.9 m120 -88.01 -32.56 18.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.033 0.444 . . . . 0.0 110.305 175.367 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3653 ' ' ILE . . . . . 0.761 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.4 OUTLIER -104.68 36.1 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-O 122.847 1.308 . . . . 0.0 109.16 -177.121 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A 3654 ' ' SER . . . . . 0.428 ' N ' ' HD2' ' A' 3655 ' ' PRO . 49.5 m -30.31 -45.61 0.26 Allowed Pre-proline 0 N--CA 1.473 0.701 0 CA-C-N 113.966 -1.47 . . . . 0.0 114.433 172.182 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3655 ' ' PRO . . . . . 0.547 ' HG2' HD13 ' A' 3653 ' ' ILE . 11.9 Cg_endo -58.28 80.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 121.826 1.684 . . . . 0.0 111.842 169.287 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -146.91 169.39 19.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.762 -176.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3657 ' ' LEU . . . . . 0.492 HD22 HG22 ' A' 3628 ' ' ILE . 50.3 mt -121.64 137.15 54.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.656 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.3 tmm? -104.39 112.55 25.64 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.156 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3659 ' ' ILE . . . . . 0.796 HD12 HD21 ' A' 3524 ' ' LEU . 73.1 mt -106.62 121.27 59.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.237 0.542 . . . . 0.0 111.59 -171.566 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3660 ' ' VAL . . . . . 0.739 HG13 ' HD2' ' A' 3573 ' ' TYR . 79.5 t -104.47 116.43 48.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.914 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3661 ' ' ILE . . . . . 0.629 HG12 ' HG ' ' A' 3626 ' ' LEU . 73.4 mt -91.07 115.72 30.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 176.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -122.96 133.58 54.37 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.226 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.1 m -78.49 110.19 13.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A 3664 ' ' VAL . . . . . 0.432 HG11 HG23 ' A' 3625 ' ' VAL . 3.4 p . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.921 -1.038 . . . . 0.0 111.262 -175.449 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 2518 ' ' TYR . . . . . 0.575 ' CD1' ' HB2' ' A' 3553 ' ' MET . 7.6 m-85 . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 119.17 -0.443 . . . . 0.0 112.144 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B 2519 ' ' GLU . . . . . 0.552 ' HG2' ' HE ' ' A' 3552 ' ' ARG . 30.6 tt0 44.49 95.94 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 172.092 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B 2520 ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' 3550 ' ' ALA . 17.5 p -57.64 131.12 49.29 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 122.291 -0.256 . . . . 0.0 111.189 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B 2521 ' ' LEU . . . . . 0.56 ' H ' ' C ' ' A' 3550 ' ' ALA . 16.7 tp . . . . . 0 C--O 1.234 0.238 0 C-N-CA 121.178 -0.209 . . . . 0.0 110.558 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.863 HG13 ' HB3' ' A' 3649 ' ' SER . 95.3 t . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 20.7 t70 -105.84 111.21 23.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.006 0.431 . . . . 0.0 110.126 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3498 ' ' MET . . . . . 0.492 ' O ' HD12 ' A' 3502 ' ' LEU . 67.7 mtm -81.57 -20.33 40.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.436 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.444 ' HA ' HD12 ' A' 3502 ' ' LEU . 21.5 t -65.8 -26.87 39.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.408 -172.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -77.16 -55.91 5.02 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.389 0.614 . . . . 0.0 110.279 172.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.61 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.0 pp -72.03 -31.97 66.68 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.493 -168.012 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.619 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.25 -16.23 63.01 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.234 -174.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.619 ' N ' HD13 ' A' 3502 ' ' LEU . 73.6 mmtt -72.0 -25.05 61.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.312 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 85.3 mttt -104.41 -44.53 4.9 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.507 0.67 . . . . 0.0 110.511 177.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.756 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -142.47 94.33 6.81 Favored Pre-proline 0 N--CA 1.435 -1.191 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.192 -176.773 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -80.64 174.17 11.41 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 123.811 3.007 . . . . 0.0 113.432 -178.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.461 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.2 mt -70.57 136.81 25.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.792 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 28.6 m -108.02 -20.33 6.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.699 -177.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.788 ' HE3' HD12 ' A' 3524 ' ' LEU . 24.2 t90 -159.69 153.16 22.45 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.643 0.259 . . . . 0.0 110.388 -176.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 23.7 tm0? -148.27 119.9 8.02 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 177.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -172.91 -129.65 1.17 Allowed Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.743 -0.741 . . . . 0.0 111.515 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.646 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -140.01 155.86 46.89 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.073 0.463 . . . . 0.0 111.196 -179.305 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.524 HD23 ' HB2' ' A' 3547 ' ' LEU . 83.2 mt -107.63 152.43 24.3 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 168.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.636 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -146.86 122.47 10.46 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.089 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.598 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.89 145.21 41.86 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 171.6 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.598 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.1 OUTLIER 59.83 -96.16 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.989 0.423 . . . . 0.0 110.069 -168.352 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -143.68 8.49 1.52 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -102.35 122.42 44.22 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.14 -173.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 66.6 p -108.62 152.7 24.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.104 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -141.61 114.75 8.71 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.193 173.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.646 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -69.01 117.2 10.36 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 176.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.421 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.9 m -131.31 148.16 32.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.426 -177.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -112.57 132.88 54.91 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.042 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.891 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -100.64 113.11 25.67 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.408 0.623 . . . . 0.0 112.189 -173.087 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.461 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 83.0 m-70 -87.32 137.56 32.24 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.481 174.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.756 ' O ' ' HB2' ' A' 3505 ' ' TYR . 62.1 t80 -66.14 139.83 58.17 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 174.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.604 ' CG1' HD23 ' A' 3575 ' ' LEU . 16.2 t -116.62 -55.64 4.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.362 0.601 . . . . 0.0 111.304 175.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.426 ' HB3' ' HB3' ' A' 3575 ' ' LEU . 13.6 t -158.02 170.14 22.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.917 -169.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.03 -152.23 24.43 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.86 175.74 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.434 ' HB2' ' HA ' ' A' 3571 ' ' THR . 52.2 t-20 -97.95 114.58 26.73 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -64.21 -28.22 69.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.73 0.3 . . . . 0.0 111.356 -177.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 60.9 t -64.84 -31.12 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.827 0.346 . . . . 0.0 110.442 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.521 HD23 ' HD3' ' A' 3536 ' ' ARG . 18.5 mt -57.31 -39.0 74.91 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.91 176.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.458 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -70.83 -44.62 66.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.852 0.358 . . . . 0.0 110.498 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 59.0 t60 -60.76 -32.51 71.81 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.023 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.521 ' HD3' HD23 ' A' 3533 ' ' LEU . 14.1 ptm180 -89.07 -18.27 27.62 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -177.523 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.483 ' HB2' HG21 ' A' 3614 ' ' VAL . 42.3 p -98.66 -39.07 8.86 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 122.128 -0.357 . . . . 0.0 111.428 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.689 HD13 ' HB2' ' A' 3509 ' ' TRP . 30.6 mt -80.27 110.69 17.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.272 -174.066 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -80.67 160.6 21.89 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 123.351 2.701 . . . . 0.0 112.882 -172.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.73 ' HA ' ' HD2' ' A' 3545 ' ' PRO . 1.3 pt? -159.14 165.87 32.79 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.293 -179.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 49.8 m -162.15 -47.25 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.084 176.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3542 ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' 3542 ' ' GLU . 0.0 OUTLIER -108.31 -30.34 8.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.867 -1.061 . . . . 0.0 109.149 176.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . -176.88 -32.71 0.05 OUTLIER Glycine 0 N--CA 1.442 -0.912 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.737 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3544 ' ' GLY . . . . . 0.419 ' HA2' ' HA ' ' A' 3540 ' ' LEU . . . 154.98 100.1 0.18 Allowed Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 121.233 -0.508 . . . . 0.0 111.992 178.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.73 ' HD2' ' HA ' ' A' 3540 ' ' LEU . 18.6 Cg_endo -58.28 146.49 88.96 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.959 2.439 . . . . 0.0 112.052 178.233 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.596 ' HA ' ' O ' ' A' 3512 ' ' LEU . 15.9 Cg_endo -57.24 120.14 7.87 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.841 2.361 . . . . 0.0 112.799 -177.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.706 ' HB3' HD13 ' A' 3612 ' ' ILE . 29.4 mt -68.92 116.4 9.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.333 177.181 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.636 ' HA ' ' O ' ' A' 3514 ' ' ALA . 16.9 ptt180 -90.35 139.07 31.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.36 -175.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.488 HD12 HD22 ' A' 3515 ' ' LEU . 31.7 mt -93.1 105.86 17.28 Favored 'Isoleucine or valine' 0 C--O 1.242 0.688 0 CA-C-O 122.066 0.936 . . . . 0.0 110.555 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -103.84 -14.56 15.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.45 -171.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.689 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 96.1 mt-30 -146.78 177.65 8.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.697 -177.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.738 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -152.82 140.95 20.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 0.0 111.689 -178.94 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.658 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 17.2 ttt -111.41 110.48 20.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.727 176.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -61.67 110.7 1.58 Allowed 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.505 ' O ' HD12 ' A' 3555 ' ' LEU . 2.4 pp -75.2 98.82 3.84 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.007 0.908 . . . . 0.0 110.023 -176.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.707 ' O ' ' HG ' ' A' 3560 ' ' LEU . 33.6 mt-10 -101.54 162.59 12.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.122 174.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.502 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -59.9 -38.02 81.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.138 0.494 . . . . 0.0 109.805 177.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 3.1 p -66.98 -41.08 87.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.162 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.676 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 77.6 mm-40 -63.68 -42.93 97.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.068 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.707 ' HG ' ' O ' ' A' 3556 ' ' GLU . 78.2 mt -60.83 -32.93 72.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.315 -178.488 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.631 ' O ' ' HD3' ' A' 3565 ' ' ARG . 10.9 mm-40 -60.95 -50.78 71.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.211 0.529 . . . . 0.0 109.72 173.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.28 -41.48 99.52 Favored Glycine 0 N--CA 1.452 -0.248 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.067 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' 3559 ' ' GLN . 69.3 t -60.47 -48.28 89.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 176.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.69 76.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.247 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.631 ' HD3' ' O ' ' A' 3561 ' ' GLU . 5.1 mpt_? -59.45 -41.73 90.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.236 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 24.7 ptt180 -88.2 -9.93 51.47 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.724 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.514 ' HG3' ' O ' ' A' 3563 ' ' VAL . 84.5 mtp -83.22 -29.41 28.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.939 0.4 . . . . 0.0 110.531 176.052 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3568 ' ' THR . . . . . 0.486 HG22 ' O ' ' A' 3565 ' ' ARG . 7.0 t -75.41 -15.1 60.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.065 0.46 . . . . 0.0 110.228 -178.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 46.0 t -103.12 87.0 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.958 177.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.4 107.64 6.68 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.434 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.1 m 155.68 -42.11 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 125.227 1.411 . . . . 0.0 107.662 -172.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.03 -30.91 31.23 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.48 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.854 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -126.67 164.03 22.19 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.201 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.615 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 38.3 t -127.59 135.59 50.49 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 171.511 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.789 HD22 HD13 ' A' 3642 ' ' LEU . 12.8 tp -106.27 125.8 51.44 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.613 HD11 HD11 ' A' 3661 ' ' ILE . 79.4 mt -127.59 154.66 44.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.158 0.504 . . . . 0.0 110.693 -177.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.699 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -119.75 109.76 15.99 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.135 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.527 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.55 119.74 33.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.366 0.603 . . . . 0.0 110.391 -179.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.492 ' HG ' HD12 ' A' 3577 ' ' LEU . 59.0 mt -119.4 142.92 33.4 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 114.721 -1.127 . . . . 0.0 109.987 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.65 113.35 1.52 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.437 2.091 . . . . 0.0 111.612 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.5 p -96.38 106.01 18.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.483 0.659 . . . . 0.0 110.448 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -102.09 147.72 17.42 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.652 178.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 48.1 ttp180 -58.75 -43.47 90.3 Favored 'General case' 0 N--CA 1.428 -1.558 0 CA-C-O 121.371 0.605 . . . . 0.0 110.421 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.631 ' O ' HG23 ' A' 3588 ' ' VAL . 3.9 p30 -142.23 177.77 8.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.012 -0.995 . . . . 0.0 108.97 178.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3585 ' ' GLN . . . . . 0.418 ' O ' HG23 ' A' 3589 ' ' VAL . 64.4 tt0 -51.93 -46.36 64.64 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.512 0.508 . . . . 0.0 111.53 -176.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -62.57 -46.66 87.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.409 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 22.8 t70 -60.54 -41.43 94.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.06 0.457 . . . . 0.0 110.632 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' 3584 ' ' ASP . 96.1 t -57.54 -45.27 86.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.574 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3589 ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' 3585 ' ' GLN . 83.0 t -57.76 -46.16 86.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.697 178.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 14.3 t -64.09 -42.88 96.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.724 -178.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -65.22 -39.94 93.44 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.628 178.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3592 ' ' THR . . . . . 0.431 ' O ' ' HG3' ' A' 3596 ' ' LYS . 31.6 m -61.85 -45.43 93.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.082 177.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -59.77 -50.09 75.18 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.921 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 61.3 m -61.08 -45.24 95.53 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.936 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.541 HD12 ' HB2' ' A' 3599 ' ' PHE . 44.8 tp -61.71 -45.33 94.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.072 -177.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.602 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 51.8 mtmt -57.95 -44.95 87.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.085 -179.615 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.88 -38.32 53.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.906 -175.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -89.69 -46.96 8.25 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -170.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.541 ' HB2' HD12 ' A' 3595 ' ' LEU . 22.9 m-85 -100.24 -50.84 3.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.721 0.296 . . . . 0.0 111.505 -175.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.602 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 32.4 mm -60.67 -58.91 5.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.841 -175.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 87.0 m -60.12 -42.57 95.06 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.363 -178.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.496 ' HE1' HD11 ' B' 2521 ' ' LEU . 40.4 t80 -65.3 -53.59 41.72 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.044 -178.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.535 HD12 ' O ' ' A' 3608 ' ' ALA . 0.3 OUTLIER -61.74 -37.15 83.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.568 0.223 . . . . 0.0 111.457 -176.599 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -76.73 -30.71 56.72 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -66.78 -36.24 81.94 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.164 0.506 . . . . 0.0 110.427 176.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -82.1 -18.49 42.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.589 178.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 50.05 54.52 10.94 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -168.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.535 ' O ' HD12 ' A' 3603 ' ' LEU . . . -136.05 -177.79 4.85 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.857 -172.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.738 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -116.67 120.2 37.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.959 176.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3610 ' ' GLY . . . . . 0.465 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.19 103.64 0.76 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 176.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.689 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 34.1 mm -89.36 117.84 33.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.239 0.542 . . . . 0.0 110.647 -174.584 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.706 HD13 ' HB3' ' A' 3547 ' ' LEU . 17.5 mt -113.74 117.2 54.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.225 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.508 ' HA ' ' O ' ' A' 3624 ' ' TYR . 87.5 m-20 -92.38 117.42 29.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.758 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.483 HG21 ' HB2' ' A' 3537 ' ' SER . 31.5 m -116.64 147.94 40.86 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.249 176.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.542 ' HA ' ' O ' ' A' 3621 ' ' GLN . 71.8 Cg_endo -91.03 143.25 3.23 Favored 'Trans proline' 0 N--CA 1.445 -1.382 0 C-N-CA 122.21 1.94 . . . . 0.0 111.602 171.171 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3616 ' ' ASN . . . . . . . . . . . . . 8.2 t30 -75.12 130.15 81.22 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 175.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -50.11 118.68 4.12 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 123.441 2.76 . . . . 0.0 112.585 -178.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 96.04 -30.31 8.74 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.288 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 7.4 m -89.5 -34.71 16.3 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.779 0.323 . . . . 0.0 110.286 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 94.0 m-20 63.26 16.45 9.45 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.337 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.542 ' O ' ' HA ' ' A' 3615 ' ' PRO . 15.8 mm-40 -99.03 117.23 64.57 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 176.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.482 ' HA ' ' O ' ' A' 3614 ' ' VAL . 74.0 Cg_endo -74.69 25.67 0.36 Allowed 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 123.468 2.779 . . . . 0.0 113.04 -178.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -77.08 32.26 0.14 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.051 0.453 . . . . 0.0 111.786 -176.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.508 ' O ' ' HA ' ' A' 3613 ' ' ASN . 38.5 m-85 -120.08 133.09 55.62 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 177.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.513 HG13 HG23 ' A' 3611 ' ' ILE . 8.1 t -116.98 114.55 46.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.612 -177.288 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.634 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -97.86 112.72 24.53 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 169.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.523 ' HB2' ' HB ' ' A' 3660 ' ' VAL . 40.5 mt-30 -94.21 110.98 22.68 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.008 -176.563 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.603 HG12 HG12 ' A' 3659 ' ' ILE . 43.5 mt -91.99 98.33 8.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.341 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -89.23 137.51 29.26 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.767 177.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.31 171.14 9.65 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.755 2.304 . . . . 0.0 111.68 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.42 52.98 2.08 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.671 2.248 . . . . 0.0 112.438 177.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 17.8 p -85.42 162.24 19.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.53 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -48.66 -45.83 39.34 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.597 0.561 . . . . 0.0 111.111 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 16.7 t80 -48.94 -46.29 43.06 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.421 177.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 7.4 m -64.67 -53.97 39.05 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.833 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -64.42 -33.13 75.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.155 -175.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 38.4 m -63.38 -48.6 77.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.106 0.479 . . . . 0.0 110.455 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -68.46 -37.66 80.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.358 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 74.0 mt -62.43 -41.76 98.95 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.667 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 5.1 p -68.35 -30.87 69.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.022 0.439 . . . . 0.0 110.831 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -79.61 -38.62 33.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.122 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.789 HD13 HD22 ' A' 3575 ' ' LEU . 19.4 mt -86.39 -37.31 18.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -144.23 74.85 15.65 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -176.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.92 -21.33 57.32 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.517 2.144 . . . . 0.0 111.828 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3645 ' ' ASP . . . . . 0.566 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.6 m-20 -73.36 -44.66 58.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.488 -177.075 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.699 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -84.5 -31.21 24.61 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 177.742 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.667 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.2 tm? -53.78 -41.31 67.07 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.577 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -64.55 -18.14 64.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.875 -178.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.863 ' HB3' HG13 ' A' 3496 ' ' VAL . 72.4 m -90.38 -34.32 15.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.824 0.345 . . . . 0.0 111.024 176.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.653 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.8 pt -83.8 -13.36 11.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.688 -174.234 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 33.7 p -58.34 -28.5 65.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.059 0.457 . . . . 0.0 110.867 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 81.4 m-20 -88.75 -33.09 17.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.074 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.653 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.4 tp -105.19 37.54 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 122.218 1.008 . . . . 0.0 109.398 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.491 ' N ' ' HD2' ' A' 3655 ' ' PRO . 7.9 m -35.72 -43.59 0.77 Allowed Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 114.15 -1.386 . . . . 0.0 113.916 173.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' 3654 ' ' SER . 15.0 Cg_endo -59.24 81.59 0.05 OUTLIER 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.925 1.75 . . . . 0.0 112.213 170.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3656 ' ' HIS . . . . . 0.461 ' CB ' HD23 ' A' 3579 ' ' LEU . 21.6 p-80 -155.18 179.7 8.9 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.734 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.458 HD22 HG22 ' A' 3628 ' ' ILE . 23.6 mt -122.75 147.86 46.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.768 -177.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.6 ttp -108.22 110.08 21.62 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 174.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.891 HD12 HD21 ' A' 3524 ' ' LEU . 78.2 mt -103.59 120.49 53.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.149 0.499 . . . . 0.0 111.597 -172.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.854 HG13 ' HD2' ' A' 3573 ' ' TYR . 95.6 t -105.6 115.94 48.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.995 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.634 HG12 ' HG ' ' A' 3626 ' ' LEU . 60.2 mt -90.61 112.4 24.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.6 127.85 56.22 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.985 0.422 . . . . 0.0 111.721 -175.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 22.3 m -81.24 114.39 20.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.108 170.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 52.0 t . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.326 -0.845 . . . . 0.0 109.97 -174.422 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.542 ' CD1' ' HB2' ' A' 3553 ' ' MET . 69.8 m-85 . . . . . 0 N--CA 1.48 1.037 0 CA-C-O 119.754 -0.165 . . . . 0.0 111.418 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.671 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 38.6 mt-10 53.56 -157.44 0.17 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.719 0.771 . . . . 0.0 111.348 177.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.42 ' H ' ' HB3' ' B' 2519 ' ' GLU . 33.3 m -144.81 114.09 7.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 166.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.663 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.5 OUTLIER -75.27 -127.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -176.896 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.543 ' N ' HD23 ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B 2523 ' ' ASP . . . . . 0.517 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 6.9 p-10 -124.37 -108.26 0.33 Allowed 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.76 -171.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.861 -0.59 . . . . 0.0 110.694 -174.669 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.672 HG13 ' HB3' ' A' 3649 ' ' SER . 48.4 t . . . . . 0 N--CA 1.478 0.947 0 N-CA-C 110.373 -0.232 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -106.18 113.86 27.65 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.862 0.363 . . . . 0.0 110.253 177.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3498 ' ' MET . . . . . 0.447 ' O ' HD12 ' A' 3502 ' ' LEU . 4.6 mpp? -81.69 -11.77 58.93 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.524 -177.205 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.418 ' HA ' HD12 ' A' 3502 ' ' LEU . 58.6 t -65.45 -24.46 34.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 CA-C-O 121.305 0.574 . . . . 0.0 111.296 -176.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -79.31 -60.87 2.2 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.969 0.414 . . . . 0.0 110.677 176.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.609 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.7 pp -61.97 -36.47 81.55 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -174.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.647 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.15 -15.84 63.01 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.467 -171.52 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.647 ' N ' HD13 ' A' 3502 ' ' LEU . 0.1 OUTLIER -72.17 -19.48 61.74 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.657 ' HD2' ' N ' ' A' 3504 ' ' LYS . 0.0 OUTLIER -104.84 -42.38 5.37 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.073 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.73 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.5 103.04 3.48 Favored Pre-proline 0 N--CA 1.446 -0.631 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.214 178.997 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3506 ' ' PRO . . . . . 0.444 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 98.3 Cg_endo -84.99 174.96 6.95 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 124.369 3.38 . . . . 0.0 113.726 -177.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.542 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.1 mt -71.3 136.36 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.432 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.416 HG13 ' HB2' ' A' 3526 ' ' PHE . 29.4 m -104.01 -22.85 4.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.344 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.651 ' HB2' HD13 ' A' 3538 ' ' LEU . 77.1 t-105 -157.73 150.23 22.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.734 -177.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -144.29 118.33 9.44 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.89 -129.53 1.09 Allowed Glycine 0 N--CA 1.441 -0.969 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 -177.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.622 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -141.64 151.46 43.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.186 0.517 . . . . 0.0 111.23 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.501 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.4 mt -105.2 148.79 26.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 169.443 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.673 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.55 124.95 13.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.691 0.281 . . . . 0.0 111.639 -177.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.761 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.56 142.42 41.34 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 173.839 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.761 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 60.38 -91.25 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.904 0.482 . . . . 0.0 109.98 -170.465 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -143.84 9.09 1.51 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -99.14 131.02 45.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.817 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.409 HG22 ' HB2' ' A' 3514 ' ' ALA . 31.1 p -119.54 145.28 46.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.498 -177.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -140.45 116.75 10.64 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.622 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.61 120.85 16.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.107 0.479 . . . . 0.0 110.078 177.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 27.5 m -128.87 148.57 33.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.562 0.696 . . . . 0.0 111.852 -175.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -110.31 125.48 53.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.986 -1.006 . . . . 0.0 108.621 172.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.849 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -96.89 107.82 20.4 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.227 0.537 . . . . 0.0 111.676 -175.378 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.542 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 62.6 m-70 -85.07 138.25 32.54 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.134 175.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.73 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.1 t80 -66.71 137.76 56.91 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 174.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.584 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.0 t -114.94 -58.11 3.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.407 0.622 . . . . 0.0 110.617 176.182 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.482 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 67.5 m -158.99 172.16 18.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.079 -170.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.13 -156.64 28.59 Favored Glycine 0 N--CA 1.453 -0.186 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.776 177.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.535 ' HB2' ' HA ' ' A' 3571 ' ' THR . 37.9 t30 -100.23 110.92 23.18 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 6.6 p30 -62.89 -26.15 68.64 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.463 -175.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3532 ' ' VAL . . . . . 0.545 ' O ' ' HG2' ' A' 3536 ' ' ARG . 80.2 t -58.4 -35.42 54.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-O 120.787 0.327 . . . . 0.0 110.418 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.559 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 40.1 mt -58.19 -42.45 86.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.031 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.449 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.09 -41.83 94.63 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.954 0.407 . . . . 0.0 110.432 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 22.8 t60 -58.7 -41.59 86.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.854 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' 3532 ' ' VAL . 14.2 ptp180 -89.5 -9.84 48.49 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.159 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.538 ' HB2' HD11 ' A' 3626 ' ' LEU . 33.7 p -99.82 -34.32 10.2 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.126 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.651 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.7 mt -81.33 104.62 3.08 Favored Pre-proline 0 C--N 1.32 -0.698 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3539 ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' 3537 ' ' SER . 57.3 Cg_endo -73.7 140.61 29.6 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 123.223 2.615 . . . . 0.0 114.763 -165.682 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.436 HD22 ' CZ3' ' A' 3509 ' ' TRP . 1.0 OUTLIER -159.42 149.87 19.24 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.243 -1.344 . . . . 0.0 110.451 172.275 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 68.3 m -161.55 -38.37 0.04 OUTLIER 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.986 -1.006 . . . . 0.0 108.974 172.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -145.17 98.03 3.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.051 178.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 87.83 -63.9 3.74 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.237 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 120.15 103.07 1.95 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.975 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.467 ' HA ' ' HD3' ' A' 3546 ' ' PRO . 4.9 Cg_exo -77.21 150.04 28.74 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 123.234 2.623 . . . . 0.0 112.376 -178.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 12.1 Cg_exo -70.89 150.11 60.79 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.81 2.34 . . . . 0.0 111.963 176.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.689 ' HB3' HD13 ' A' 3612 ' ' ILE . 37.5 mt -81.58 115.73 21.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.912 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' A' 3514 ' ' ALA . 29.1 ptt85 -90.45 140.46 29.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.2 -178.466 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.473 ' HA ' HG12 ' A' 3612 ' ' ILE . 17.6 mt -92.39 107.86 19.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 CA-C-O 121.944 0.878 . . . . 0.0 110.617 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.55 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.04 -3.17 14.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.064 -172.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.679 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 54.5 mt-30 -151.39 173.19 14.83 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.402 0.144 . . . . 0.0 111.127 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.681 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.42 139.65 17.54 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.847 0.356 . . . . 0.0 111.269 -179.658 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.668 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 16.5 ttt -109.17 142.67 39.64 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.101 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -77.66 110.94 12.93 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.634 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -76.86 97.76 4.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.109 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.637 ' HB2' ' HG2' ' A' 3559 ' ' GLN . 19.4 mm-40 -115.94 165.07 13.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.523 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.589 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.48 -54.6 38.8 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.176 0.297 . . . . 0.0 111.301 -178.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 27.0 p -62.48 -38.29 89.3 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 111.305 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.637 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 29.1 mm-40 -65.97 -46.86 76.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.995 -177.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' 3556 ' ' GLU . 92.0 mt -63.57 -32.01 73.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.084 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.6 mm-40 -65.34 -46.11 81.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.236 0.541 . . . . 0.0 109.952 175.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.17 99.64 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.099 176.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.532 ' O ' ' HG3' ' A' 3567 ' ' MET . 80.8 t -59.63 -45.67 94.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.903 0.382 . . . . 0.0 110.217 175.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.89 -30.04 68.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.737 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -62.35 -37.47 85.78 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -88.01 -7.79 56.56 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.646 176.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' 3563 ' ' VAL . 80.6 mtp -87.21 -24.25 24.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.619 177.591 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 31.0 p -81.87 -22.43 36.93 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.233 0.539 . . . . 0.0 110.275 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 39.7 t -93.26 80.41 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.644 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -67.21 109.2 2.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.01 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.535 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.0 m 151.77 -40.86 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.587 1.555 . . . . 0.0 108.016 -175.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -86.3 -17.51 34.41 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.689 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.778 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -136.2 163.12 31.11 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.028 0.442 . . . . 0.0 109.976 177.497 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.594 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 43.7 t -126.32 135.63 51.73 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 171.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.77 HD22 HD13 ' A' 3642 ' ' LEU . 14.8 tp -105.4 125.89 51.5 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.576 HD11 HD11 ' A' 3661 ' ' ILE . 73.5 mt -127.16 154.73 44.4 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.758 -177.348 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.781 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -121.78 108.84 13.97 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.959 178.825 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.521 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.75 123.16 38.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.384 0.611 . . . . 0.0 110.534 -178.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.46 HD23 ' HB2' ' A' 3656 ' ' HIS . 57.6 mt -125.28 145.57 51.19 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.205 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.22 116.02 2.98 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.415 2.077 . . . . 0.0 111.814 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.8 p -100.73 105.32 16.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.192 0.52 . . . . 0.0 110.842 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.13 145.79 16.15 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.36 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3583 ' ' ARG . . . . . 0.583 ' HG2' ' HB2' ' A' 3587 ' ' ASP . 9.0 ptp85 -61.44 -32.72 72.7 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.142 0.496 . . . . 0.0 110.993 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.609 ' O ' HG23 ' A' 3588 ' ' VAL . 2.8 p-10 -152.26 -179.45 7.55 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.799 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -49.52 -44.93 46.72 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.591 0.557 . . . . 0.0 111.479 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.93 -49.12 73.85 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 120.823 0.344 . . . . 0.0 110.773 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.583 ' HB2' ' HG2' ' A' 3583 ' ' ARG . 15.8 t0 -62.74 -42.92 99.9 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.968 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' 3584 ' ' ASP . 89.7 t -56.82 -49.35 79.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.674 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 70.9 t -62.19 -44.96 99.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.528 -179.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 32.6 t -61.06 -39.17 88.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.922 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3591 ' ' GLN . . . . . 0.476 ' HA ' ' OE1' ' A' 3591 ' ' GLN . 12.6 mm-40 -72.83 -35.59 67.31 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.576 178.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 63.9 m -61.01 -53.18 60.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.566 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.538 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 11.1 pt-20 -63.17 -38.67 92.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.171 -178.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.1 m -65.88 -46.52 78.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 0.0 110.56 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.558 HD12 ' HB2' ' A' 3599 ' ' PHE . 62.1 tp -62.44 -45.89 91.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.264 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.847 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 62.7 pttt -70.1 -26.87 64.18 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.48 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.55 -39.47 20.35 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.929 0.395 . . . . 0.0 111.305 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.458 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -89.74 -46.07 8.86 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -172.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.558 ' HB2' HD12 ' A' 3595 ' ' LEU . 18.9 m-85 -99.37 -50.35 4.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.667 0.27 . . . . 0.0 111.619 -175.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.847 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.1 mm -62.15 -55.7 22.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 -176.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 90.4 m -58.04 -43.68 86.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.001 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.728 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -61.11 -56.93 15.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.895 -0.138 . . . . 0.0 110.782 177.722 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.728 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.7 -43.38 80.46 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -178.671 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -71.58 -38.63 70.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.774 0.321 . . . . 0.0 110.508 -176.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.72 67.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.942 0.401 . . . . 0.0 111.062 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3606 ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' 3602 ' ' TYR . 73.4 mmtt -83.18 -19.56 36.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.737 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3607 ' ' GLN . . . . . 0.589 ' O ' ' HG ' ' A' 3555 ' ' LEU . 77.6 mt-30 54.3 47.46 22.95 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -170.249 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.575 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -127.44 179.0 5.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.791 -171.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.681 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -117.7 118.16 31.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.02 171.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3610 ' ' GLY . . . . . 0.458 ' N ' HD11 ' A' 3603 ' ' LEU . . . -65.45 102.76 0.71 Allowed Glycine 0 C--O 1.221 -0.672 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.493 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.679 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 30.2 mm -88.88 119.89 36.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.229 0.537 . . . . 0.0 110.695 -175.155 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.689 HD13 ' HB3' ' A' 3547 ' ' LEU . 36.3 mt -114.86 106.53 20.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.165 176.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.447 ' HA ' ' O ' ' A' 3624 ' ' TYR . 79.9 m-20 -84.49 129.06 34.89 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.869 176.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' 3537 ' ' SER . 3.3 p -134.62 133.77 21.65 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.656 -178.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.511 ' HA ' ' O ' ' A' 3621 ' ' GLN . 74.1 Cg_endo -78.78 137.04 13.87 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.299 1.999 . . . . 0.0 112.353 175.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.711 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 11.1 t30 -67.2 121.81 80.07 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.901 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -48.9 121.16 6.26 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.386 2.724 . . . . 0.0 112.996 -175.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 95.28 -36.23 3.91 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.909 -0.663 . . . . 0.0 112.346 178.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 4.3 m -90.14 -28.45 18.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.863 0.363 . . . . 0.0 110.231 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 2.5 m-20 65.89 18.99 11.24 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.338 178.158 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.511 ' O ' ' HA ' ' A' 3615 ' ' PRO . 33.2 mt-30 -89.94 114.92 62.58 Favored Pre-proline 0 C--N 1.327 -0.41 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 91.9 Cg_endo -84.15 24.33 0.76 Allowed 'Trans proline' 0 CA--C 1.529 0.251 0 C-N-CA 123.406 2.737 . . . . 0.0 112.959 -175.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -79.41 37.75 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.99 0.424 . . . . 0.0 111.944 -176.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.711 ' HE2' ' HB2' ' A' 3616 ' ' ASN . 72.2 m-85 -123.9 132.86 53.81 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.084 177.023 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.475 HG13 HG23 ' A' 3611 ' ' ILE . 11.5 t -120.56 113.46 40.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.003 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.665 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -96.3 110.97 23.19 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 170.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.481 ' HB2' ' HB ' ' A' 3660 ' ' VAL . 44.0 mt-30 -94.1 111.9 23.66 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.205 -177.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.595 HG12 HG12 ' A' 3659 ' ' ILE . 37.1 mt -92.05 97.83 7.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.099 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -89.71 135.92 30.06 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.761 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.564 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 37.3 Cg_endo -66.38 171.02 11.1 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.819 2.346 . . . . 0.0 111.698 177.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.27 42.4 0.38 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.129 2.553 . . . . 0.0 113.126 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 24.1 p -75.37 161.78 28.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.425 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -53.18 -35.73 60.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.516 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 24.2 t80 -53.01 -48.73 67.31 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.888 0.375 . . . . 0.0 111.059 176.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 10.8 m -67.05 -52.52 41.24 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.39 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -57.17 -43.56 82.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.676 -176.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 23.3 m -65.65 -46.35 79.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.035 0.445 . . . . 0.0 110.613 -177.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 8.0 m80 -63.69 -38.5 91.35 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.696 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 69.3 mt -65.76 -40.83 92.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.809 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.65 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 11.6 p -68.59 -27.09 65.74 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.841 -0.343 . . . . 0.0 110.822 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.3 -47.11 13.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 176.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.77 HD13 HD22 ' A' 3575 ' ' LEU . 20.8 mt -77.04 -40.95 44.46 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.394 -173.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.482 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -143.09 86.7 9.06 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-O 120.756 0.313 . . . . 0.0 111.216 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.37 -23.07 28.44 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.662 2.241 . . . . 0.0 113.475 -174.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 20.0 t0 -78.37 -49.41 13.61 Favored 'General case' 0 CA--C 1.516 -0.335 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.241 -174.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.781 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -72.3 -30.48 64.83 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.135 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.65 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -55.78 -45.89 78.06 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.131 177.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.06 -27.69 68.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.035 0.445 . . . . 0.0 111.206 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.672 ' HB3' HG13 ' A' 3496 ' ' VAL . 6.9 m -79.28 -39.3 33.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.705 178.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.681 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.6 pt -80.79 -11.72 12.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 120.903 0.382 . . . . 0.0 111.522 -174.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 45.5 m -57.94 -26.98 62.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.447 175.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -87.06 -34.74 19.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.368 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.681 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.1 tp -104.35 40.19 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-O 122.292 1.044 . . . . 0.0 109.635 -179.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.44 ' N ' ' HD2' ' A' 3655 ' ' PRO . 49.3 m -33.38 -44.66 0.46 Allowed Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 114.113 -1.403 . . . . 0.0 113.829 169.257 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.49 ' HG2' HD12 ' A' 3653 ' ' ILE . 13.5 Cg_endo -59.53 76.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 121.707 1.605 . . . . 0.0 111.819 169.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3656 ' ' HIS . . . . . 0.46 ' HB2' HD23 ' A' 3579 ' ' LEU . 18.5 p80 -146.22 174.06 11.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.781 -176.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.506 HD22 HG22 ' A' 3628 ' ' ILE . 36.5 mt -123.33 144.96 49.11 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.482 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 55.6 ttp -107.17 110.46 22.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.849 HD12 HD21 ' A' 3524 ' ' LEU . 88.9 mt -101.52 115.75 43.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.433 0.635 . . . . 0.0 111.32 -173.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.778 HG13 ' HD2' ' A' 3573 ' ' TYR . 90.8 t -102.75 112.03 34.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.615 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.665 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.7 mt -90.38 112.57 25.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.102 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -112.18 127.46 55.95 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.843 0.354 . . . . 0.0 110.953 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 15.1 p -94.62 109.63 21.53 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 172.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--O 1.249 1.073 0 CA-C-O 117.894 -1.051 . . . . 0.0 111.256 -175.916 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.477 ' CD1' ' HB2' ' A' 3553 ' ' MET . 46.7 m-85 . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.558 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.4 OUTLIER 55.37 -156.65 0.25 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.802 0.81 . . . . 0.0 111.879 174.495 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.434 ' H ' ' HB3' ' B' 2519 ' ' GLU . 4.2 t -153.45 127.01 8.69 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.321 -1.309 . . . . 0.0 107.682 167.58 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.571 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER -81.9 -127.68 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -177.307 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.676 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 13.8 t70 -169.14 -71.58 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.905 -177.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.252 -0.88 . . . . 0.0 109.431 174.253 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.75 HG13 ' HB3' ' A' 3649 ' ' SER . 45.9 t . . . . . 0 N--CA 1.477 0.924 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 29.8 t70 -104.78 120.21 40.83 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.985 0.421 . . . . 0.0 111.008 -178.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3498 ' ' MET . . . . . 0.478 ' O ' HD12 ' A' 3502 ' ' LEU . 3.1 mpp? -80.77 -24.24 38.77 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.93 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.479 ' HA ' HD12 ' A' 3502 ' ' LEU . 22.1 t -65.3 -25.06 36.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.18 0.514 . . . . 0.0 111.123 -174.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -77.35 -56.77 4.26 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.104 0.478 . . . . 0.0 110.76 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.524 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp -70.04 -32.33 70.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -170.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.605 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -71.2 -15.71 62.48 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.177 -174.786 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.605 ' N ' HD13 ' A' 3502 ' ' LEU . 52.3 tptt -71.04 -18.31 62.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.494 0.664 . . . . 0.0 109.46 177.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.44 ' HB3' ' CE2' ' A' 3505 ' ' TYR . 29.2 mmtp -104.91 -44.65 4.77 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.92 174.136 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.697 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -151.87 105.6 2.85 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.553 -177.671 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 3506 ' ' PRO . . . . . 0.466 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 88.7 Cg_endo -83.69 173.73 9.19 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.952 3.101 . . . . 0.0 113.655 -175.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.59 HG12 ' CD2' ' A' 3525 ' ' HIS . 61.3 mt -71.56 132.03 33.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.524 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.477 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.3 m -100.38 -31.34 3.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.587 -178.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.597 ' HB2' HD13 ' A' 3538 ' ' LEU . 51.4 t-105 -148.59 155.13 40.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 110.521 -177.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -149.02 120.04 7.69 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 176.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -169.58 -127.34 0.92 Allowed Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.649 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.2 mp -141.37 153.91 45.35 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.005 0.431 . . . . 0.0 110.82 178.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.485 HD23 ' HB2' ' A' 3547 ' ' LEU . 98.2 mt -107.78 150.83 26.51 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 169.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.746 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -147.83 124.5 11.13 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.779 0.323 . . . . 0.0 111.608 -178.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.603 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -136.41 139.58 42.55 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 174.256 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.749 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.0 OUTLIER 62.49 -95.26 0.05 OUTLIER 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 -167.634 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -140.16 6.6 2.16 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.188 176.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.503 ' O ' ' HA ' ' A' 3514 ' ' ALA . 11.9 m-20 -91.22 127.86 36.82 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.366 -174.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.534 HG22 ' HB2' ' A' 3514 ' ' ALA . 40.4 p -119.89 145.3 46.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.936 0.398 . . . . 0.0 111.627 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -142.87 120.16 11.56 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 174.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.645 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.93 118.6 16.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.964 0.412 . . . . 0.0 109.937 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.433 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 33.5 m -126.55 147.59 31.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.725 0.774 . . . . 0.0 112.525 -174.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -106.24 125.31 50.83 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.614 171.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.89 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -96.16 106.43 18.62 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.42 0.629 . . . . 0.0 111.176 -177.875 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.59 ' CD2' HG12 ' A' 3507 ' ' ILE . 29.1 m170 -82.96 138.79 33.67 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.407 176.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.697 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.8 t80 -68.93 137.28 53.68 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 174.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.578 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.3 t -114.66 -56.52 4.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.447 0.641 . . . . 0.0 110.871 177.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.419 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 37.6 m -162.87 171.88 15.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.091 -171.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.61 -155.12 26.59 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.348 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3530 ' ' ASN . . . . . . . . . . . . . 39.2 t30 -100.18 113.82 26.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.619 0.247 . . . . 0.0 110.77 -178.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -64.12 -27.84 69.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.461 -177.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 49.4 t -60.33 -33.09 52.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.865 0.364 . . . . 0.0 110.362 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.476 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 23.0 mt -60.15 -39.76 87.49 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.968 178.041 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.489 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -67.54 -41.36 84.41 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.542 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 32.3 t60 -64.33 -35.0 79.45 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.895 0.379 . . . . 0.0 110.723 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.45 ' HD3' HD23 ' A' 3533 ' ' LEU . 13.3 ptm180 -89.25 -8.99 52.36 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -177.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.449 ' O ' HG21 ' A' 3614 ' ' VAL . 34.0 p -104.87 -39.89 6.13 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.557 177.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.597 HD13 ' HB2' ' A' 3509 ' ' TRP . 26.0 mt -80.69 109.34 12.75 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.039 0.447 . . . . 0.0 109.911 -174.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3539 ' ' PRO . . . . . 0.451 ' HD3' HG21 ' A' 3614 ' ' VAL . 61.1 Cg_endo -78.61 149.92 24.19 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.995 2.464 . . . . 0.0 113.057 -172.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.403 ' HB3' ' CH2' ' A' 3509 ' ' TRP . 1.0 OUTLIER -157.41 162.26 38.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.162 176.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 22.9 t -176.85 -45.09 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -143.31 114.54 7.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.145 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 68.03 -102.53 0.86 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.003 -178.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -169.46 102.66 0.18 Allowed Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 111.569 -0.612 . . . . 0.0 111.569 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.76 142.98 65.61 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.788 2.325 . . . . 0.0 112.605 -177.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.649 ' HA ' ' O ' ' A' 3512 ' ' LEU . 74.0 Cg_endo -79.64 123.09 5.21 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 122.51 2.14 . . . . 0.0 112.632 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.782 ' HB3' HD13 ' A' 3612 ' ' ILE . 55.3 mt -69.18 120.07 14.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.033 176.587 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.746 ' HA ' ' O ' ' A' 3514 ' ' ALA . 14.3 ptt180 -93.7 141.14 28.82 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.838 0.351 . . . . 0.0 111.285 -176.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.666 ' CG2' HD23 ' B' 2521 ' ' LEU . 25.2 mt -99.03 106.19 18.52 Favored 'Isoleucine or valine' 0 C--O 1.245 0.84 0 CA-C-O 121.922 0.867 . . . . 0.0 111.075 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.487 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.03 0.06 14.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.607 -174.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.642 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 57.3 mt-30 -148.55 175.31 11.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.514 178.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.806 ' HD3' ' HB2' ' B' 2521 ' ' LEU . 0.0 OUTLIER -159.85 140.11 11.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 111.752 -177.182 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.582 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -110.86 120.46 42.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.226 177.145 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3554 ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' 3554 ' ' ARG . 14.8 mmt180 -68.44 109.52 3.73 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.521 ' O ' HD12 ' A' 3555 ' ' LEU . 2.4 pp -71.56 98.3 1.85 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 122.209 1.004 . . . . 0.0 109.623 -177.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.518 ' O ' ' HG ' ' A' 3560 ' ' LEU . 36.3 mt-10 -108.87 164.72 12.14 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.026 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.634 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.16 -50.46 66.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.015 0.436 . . . . 0.0 110.214 179.183 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 3.0 p -60.5 -40.76 92.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.617 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.527 ' O ' HG23 ' A' 3563 ' ' VAL . 15.2 mm-40 -63.36 -50.1 71.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.697 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' 3556 ' ' GLU . 85.0 mt -61.13 -31.88 71.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.297 -176.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.634 ' HG2' ' O ' ' A' 3557 ' ' ALA . 18.3 mm-40 -60.74 -50.85 71.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.226 0.536 . . . . 0.0 109.754 174.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3562 ' ' GLY . . . . . 0.409 ' HA2' ' HD2' ' A' 3565 ' ' ARG . . . -63.87 -39.64 97.56 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.168 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.556 ' O ' ' HG3' ' A' 3567 ' ' MET . 90.4 t -60.24 -48.54 87.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.59 0.234 . . . . 0.0 110.782 177.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.66 -30.35 68.68 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.574 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.518 ' HG3' ' O ' ' A' 3561 ' ' GLU . 99.7 mtt180 -57.64 -42.36 83.27 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.528 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3566 ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' 3563 ' ' VAL . 11.5 ptp180 -87.06 -13.59 43.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.949 0.404 . . . . 0.0 110.604 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.556 ' HG3' ' O ' ' A' 3563 ' ' VAL . 85.6 mtp -79.53 -26.54 41.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.988 0.423 . . . . 0.0 110.593 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 15.1 t -85.0 1.37 47.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.188 0.518 . . . . 0.0 110.065 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 40.9 t -116.7 84.32 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.489 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.785 176.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -72.8 108.49 5.79 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3571 ' ' THR . . . . . . . . . . . . . 1.5 m 155.38 -43.52 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 O-C-N 124.998 1.436 . . . . 0.0 108.059 -173.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -86.65 -27.29 23.88 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.968 -177.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.771 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -129.41 162.08 28.87 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.939 178.215 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.625 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 48.8 t -124.41 136.91 54.43 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 170.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.791 HD22 HD13 ' A' 3642 ' ' LEU . 14.6 tp -105.85 125.44 50.99 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.634 HD11 HD11 ' A' 3661 ' ' ILE . 82.3 mt -127.11 153.21 46.3 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.111 0.481 . . . . 0.0 110.725 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.644 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.44 107.15 12.54 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.15 -179.538 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.465 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 124.01 38.16 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.416 0.627 . . . . 0.0 110.473 -177.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.476 HD23 ' HB2' ' A' 3656 ' ' HIS . 84.8 mt -125.42 146.31 53.97 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.155 -178.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.32 117.04 3.72 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.195 1.93 . . . . 0.0 111.88 176.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.2 p -107.21 106.7 17.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.286 0.565 . . . . 0.0 110.579 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3582 ' ' GLY . . . . . 0.405 ' H ' HG22 ' A' 3588 ' ' VAL . . . -103.61 147.13 16.62 Favored Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.265 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3583 ' ' ARG . . . . . 0.423 ' HG2' ' CB ' ' A' 3587 ' ' ASP . 35.5 ptt180 -59.01 -35.03 72.56 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.254 0.55 . . . . 0.0 111.115 177.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.573 ' O ' HG23 ' A' 3588 ' ' VAL . 10.3 t70 -142.84 174.19 10.88 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -55.93 -33.86 65.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 118.613 0.642 . . . . 0.0 109.916 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3586 ' ' GLU . . . . . 0.407 ' HG3' ' H ' ' A' 3586 ' ' GLU . 20.1 mt-10 -56.49 -54.68 42.93 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.379 175.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.502 ' O ' ' HG2' ' A' 3591 ' ' GLN . 3.1 t70 -65.84 -36.04 82.35 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.718 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' 3584 ' ' ASP . 99.2 t -57.49 -48.03 83.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.299 178.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 65.9 t -60.19 -44.06 94.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.02 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 43.7 t -60.7 -46.59 89.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.153 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3591 ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' 3587 ' ' ASP . 70.9 mm-40 -65.15 -41.48 94.69 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 178.281 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 59.5 m -59.63 -53.28 59.83 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.959 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.39 -36.97 85.89 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.08 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 46.1 m -67.37 -44.52 78.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.883 0.373 . . . . 0.0 110.398 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.554 HD12 ' HB2' ' A' 3599 ' ' PHE . 46.5 tp -65.11 -46.4 81.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.983 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.772 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.93 -31.06 71.77 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.084 -176.989 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.09 -42.26 17.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.674 0.274 . . . . 0.0 111.363 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.4 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -88.16 -45.67 9.92 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -170.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.554 ' HB2' HD12 ' A' 3595 ' ' LEU . 14.3 m-85 -99.48 -50.27 4.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.766 0.317 . . . . 0.0 111.245 -176.293 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.772 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 26.0 mm -61.56 -60.04 3.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.217 -175.584 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 88.8 m -59.08 -32.09 69.47 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 123.185 0.303 . . . . 0.0 111.238 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 42.1 t80 -77.09 -57.04 4.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.569 -177.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' 3608 ' ' ALA . 0.4 OUTLIER -55.97 -38.62 70.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.235 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.39 -32.82 64.68 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.859 -0.337 . . . . 0.0 110.168 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.48 93.54 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.209 0.528 . . . . 0.0 110.689 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -81.38 -16.82 51.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.057 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3607 ' ' GLN . . . . . 0.418 ' O ' ' HG ' ' A' 3555 ' ' LEU . 55.1 mt-30 53.22 49.58 19.59 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -169.478 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.554 ' O ' HD12 ' A' 3603 ' ' LEU . . . -131.12 -178.78 4.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.334 0.588 . . . . 0.0 112.373 -171.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.752 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.81 118.35 30.59 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.572 176.112 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3610 ' ' GLY . . . . . 0.419 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.61 104.84 0.92 Allowed Glycine 0 C--O 1.222 -0.594 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.562 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.642 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 36.4 mm -89.6 121.67 40.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.207 0.527 . . . . 0.0 111.066 -175.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.782 HD13 ' HB3' ' A' 3547 ' ' LEU . 19.3 mt -117.07 113.01 41.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.024 177.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.443 ' HA ' ' O ' ' A' 3624 ' ' TYR . 19.0 m120 -92.09 108.01 19.63 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.445 -179.234 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.451 HG21 ' HD3' ' A' 3539 ' ' PRO . 7.2 p -120.16 138.62 27.33 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.635 -171.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.716 ' HB2' ' HA ' ' A' 3620 ' ' ASN . 74.9 Cg_endo -81.73 141.51 12.25 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 122.556 2.17 . . . . 0.0 112.097 173.184 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.554 ' OD1' ' HB3' ' A' 3619 ' ' SER . 10.9 p30 -72.17 131.61 85.07 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 120.996 0.427 . . . . 0.0 111.064 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.51 122.78 12.17 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.899 2.399 . . . . 0.0 112.45 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 107.51 -42.56 1.9 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 121.088 -0.577 . . . . 0.0 112.706 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3619 ' ' SER . . . . . 0.554 ' HB3' ' OD1' ' A' 3616 ' ' ASN . 12.6 t -106.03 -28.96 10.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.73 0.3 . . . . 0.0 110.63 -176.108 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3620 ' ' ASN . . . . . 0.716 ' HA ' ' HB2' ' A' 3615 ' ' PRO . 3.6 m-20 66.32 30.42 8.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.372 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.558 ' O ' ' HA ' ' A' 3615 ' ' PRO . 97.8 mt-30 -83.62 112.97 43.97 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 173.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 89.6 Cg_endo -83.55 23.62 0.81 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.062 2.508 . . . . 0.0 113.453 -173.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -82.34 49.48 1.44 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.575 -177.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.443 ' O ' ' HA ' ' A' 3613 ' ' ASN . 82.7 m-85 -135.8 134.16 38.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.891 0.377 . . . . 0.0 110.726 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.423 HG13 HD12 ' A' 3611 ' ' ILE . 4.4 t -118.76 113.92 43.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.287 178.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.624 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.9 mp -97.83 115.53 28.24 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 169.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.56 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 44.0 mt-30 -94.72 111.44 23.22 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.702 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.599 HG12 HG12 ' A' 3659 ' ' ILE . 38.7 mt -90.16 98.59 8.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.254 178.696 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -86.83 139.72 33.05 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.096 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -67.94 172.81 10.19 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.695 2.263 . . . . 0.0 111.52 176.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.21 43.59 0.5 Allowed 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 122.892 2.395 . . . . 0.0 112.58 176.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 24.5 p -74.82 162.84 28.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.767 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -52.25 -40.75 62.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.202 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 31.3 t80 -50.43 -44.65 55.42 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.122 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.5 m -67.54 -56.92 7.58 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.655 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -57.11 -41.42 78.93 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.323 -0.399 . . . . 0.0 112.056 -175.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 12.0 p -66.83 -47.23 72.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.913 0.387 . . . . 0.0 110.869 -177.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 22.4 m-70 -66.9 -36.99 83.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.508 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 77.5 mt -61.89 -35.85 79.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.72 0.295 . . . . 0.0 110.819 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.876 ' HA ' HD22 ' A' 3647 ' ' LEU . 38.2 t -63.4 -37.77 88.58 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.182 0.515 . . . . 0.0 110.491 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3641 ' ' ARG . . . . . 0.594 ' HA ' ' NE ' ' A' 3641 ' ' ARG . 1.7 mmp_? -80.44 -32.23 37.34 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.011 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.791 HD13 HD22 ' A' 3575 ' ' LEU . 32.8 mt -96.63 -27.15 14.94 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -171.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.432 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -159.32 79.69 2.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -178.081 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3644 ' ' PRO . . . . . 0.514 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 3.0 Cg_exo -73.75 -18.75 21.83 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.635 2.224 . . . . 0.0 111.546 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3645 ' ' ASP . . . . . 0.483 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 6.9 m-20 -69.52 -49.91 50.05 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.123 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.644 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -82.71 -25.01 33.35 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.278 179.147 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.876 HD22 ' HA ' ' A' 3640 ' ' SER . 34.8 tp -52.6 -49.69 64.53 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.581 178.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.52 -18.47 59.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.009 0.433 . . . . 0.0 111.632 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.75 ' HB3' HG13 ' A' 3496 ' ' VAL . 15.5 m -87.33 -38.26 16.39 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.59 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.61 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.0 pt -78.72 -21.76 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -175.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 47.2 m -52.39 -30.31 28.4 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 120.765 0.317 . . . . 0.0 111.326 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -82.96 -42.86 17.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.951 0.405 . . . . 0.0 109.954 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.61 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.6 tp -96.88 39.07 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-O 122.76 1.267 . . . . 0.0 109.168 -178.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.492 ' N ' ' HD2' ' A' 3655 ' ' PRO . 4.3 p -40.41 -37.26 0.84 Allowed Pre-proline 0 CA--C 1.545 0.766 0 CA-C-N 113.449 -1.705 . . . . 0.0 114.961 174.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' 3654 ' ' SER . 22.9 Cg_endo -63.89 74.07 0.17 Allowed 'Trans proline' 0 C--N 1.358 1.038 0 CA-C-N 121.053 1.412 . . . . 0.0 111.529 170.13 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3656 ' ' HIS . . . . . 0.476 ' HB2' HD23 ' A' 3579 ' ' LEU . 18.1 p80 -139.36 173.78 11.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.323 -175.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.473 HD22 HG22 ' A' 3628 ' ' ILE . 32.3 mt -121.69 148.46 44.57 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.33 178.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.3 ttp -111.21 107.89 17.36 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 174.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.89 HD12 HD21 ' A' 3524 ' ' LEU . 74.9 mt -100.91 117.26 45.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.285 0.564 . . . . 0.0 111.524 -171.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.771 HG13 ' HD2' ' A' 3573 ' ' TYR . 56.5 t -101.76 115.93 44.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.147 -178.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.634 HD11 HD11 ' A' 3576 ' ' LEU . 68.0 mt -90.34 113.12 25.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 177.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -108.94 127.34 53.98 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.914 0.388 . . . . 0.0 110.851 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 32.0 t -93.47 136.4 33.78 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.69 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 5.1 m . . . . . 0 C--O 1.246 0.907 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.453 179.739 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.582 ' CD1' ' HB2' ' A' 3553 ' ' MET . 11.8 m-85 . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.634 ' HG2' ' H ' ' B' 2520 ' ' THR . 35.6 tt0 57.85 -163.34 0.2 Allowed 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 174.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.634 ' H ' ' HG2' ' B' 2519 ' ' GLU . 41.3 m -150.56 124.23 9.13 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.806 ' HB2' ' HD3' ' A' 3552 ' ' ARG . 7.1 tp -90.35 -126.17 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.463 -179.068 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.749 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 4.2 t70 -165.57 -66.77 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.656 -177.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 . . . . . 0 C--O 1.248 0.981 0 CA-C-O 118.717 -0.659 . . . . 0.0 110.054 -175.824 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.688 HG13 ' HB3' ' A' 3649 ' ' SER . 47.6 t . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 37.7 t70 -95.42 111.58 23.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.024 0.44 . . . . 0.0 110.198 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3498 ' ' MET . . . . . 0.691 ' HG2' ' HB3' ' A' 3502 ' ' LEU . 51.5 ttp -80.95 -18.33 47.42 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.228 -176.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.413 ' HA ' HD12 ' A' 3502 ' ' LEU . 35.6 t -57.19 -24.69 21.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.303 0.573 . . . . 0.0 110.877 -178.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -78.12 -60.28 2.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.298 0.57 . . . . 0.0 110.566 173.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.54 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.0 pp -71.34 -31.48 67.43 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -170.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.691 ' HB3' ' HG2' ' A' 3498 ' ' MET . 0.0 OUTLIER -67.48 -16.96 64.5 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.677 0.671 . . . . 0.0 110.278 -175.327 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.652 ' N ' HD13 ' A' 3502 ' ' LEU . 56.0 tptt -66.42 -25.8 66.92 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 121.358 0.599 . . . . 0.0 109.385 177.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 61.1 mmtt -105.58 -42.23 5.26 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.992 177.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.637 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.19 105.64 3.16 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 121.503 0.668 . . . . 0.0 111.521 -177.657 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -82.86 175.34 8.74 Favored 'Trans proline' 0 CA--C 1.533 0.43 0 C-N-CA 124.24 3.293 . . . . 0.0 113.248 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.487 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 90.9 mt -70.78 132.85 32.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.136 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.565 HG13 ' HB2' ' A' 3526 ' ' PHE . 29.2 m -100.76 -26.39 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.189 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.666 ' CZ2' ' HA3' ' A' 3544 ' ' GLY . 43.2 t-105 -154.89 156.37 36.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.882 0.372 . . . . 0.0 110.779 -178.381 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3510 ' ' GLN . . . . . 0.436 HE21 ' HB3' ' A' 3510 ' ' GLN . 0.9 OUTLIER -151.29 119.22 6.21 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.966 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.74 -131.05 1.29 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.485 -0.646 . . . . 0.0 111.485 -176.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.637 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -140.55 150.38 43.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.217 0.532 . . . . 0.0 111.569 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.46 HD23 ' HB2' ' A' 3547 ' ' LEU . 83.1 mt -105.55 154.02 20.96 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 170.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.718 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -148.72 126.53 11.86 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.491 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.689 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.68 140.62 38.88 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 172.549 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.812 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.4 OUTLIER 62.52 -93.0 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -169.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 8.8 m120 -143.36 11.34 1.71 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 171.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.537 ' HB3' ' HB1' ' A' 3598 ' ' ALA . 27.9 m-20 -88.03 116.98 26.59 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.152 -176.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 21.8 p -110.54 133.42 53.31 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.91 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3520 ' ' ALA . . . . . 1.009 ' HB1' HE22 ' A' 3591 ' ' GLN . . . -135.11 120.1 18.63 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.379 177.005 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.637 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.93 117.76 16.09 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.209 0.528 . . . . 0.0 110.493 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.423 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 28.9 m -127.95 147.48 32.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.725 0.774 . . . . 0.0 112.126 -175.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -105.71 125.81 51.42 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.937 173.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.843 HD21 HD12 ' A' 3659 ' ' ILE . 2.0 mt -97.06 105.96 18.21 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.498 0.666 . . . . 0.0 111.573 -176.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.487 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 26.0 m-70 -86.26 138.9 31.5 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.922 -1.035 . . . . 0.0 108.695 176.334 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.637 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.7 t80 -68.57 139.32 55.56 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.556 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.8 t -114.83 -55.67 4.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-O 121.298 0.57 . . . . 0.0 110.994 177.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 58.5 m -163.75 170.76 16.5 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.276 -172.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.87 -150.96 22.66 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.483 174.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.532 ' HB2' ' HA ' ' A' 3571 ' ' THR . 53.8 t-20 -93.45 107.74 19.53 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.342 -0.429 . . . . 0.0 110.553 -175.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -64.06 -30.82 71.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.634 0.254 . . . . 0.0 110.947 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 45.0 t -64.22 -31.57 53.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.955 0.407 . . . . 0.0 110.007 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.513 HD12 ' HB3' ' A' 3530 ' ' ASN . 16.6 mt -59.39 -40.2 85.81 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.774 176.426 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.408 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.87 -39.35 87.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.909 0.385 . . . . 0.0 110.267 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -61.35 -40.18 93.33 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -89.43 -10.13 47.62 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -176.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.652 ' O ' HG11 ' A' 3614 ' ' VAL . 77.5 p -103.87 -37.15 7.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.932 0.396 . . . . 0.0 111.416 -179.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.64 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.1 mt -81.85 111.35 25.82 Favored Pre-proline 0 C--N 1.318 -0.783 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -65.93 131.83 28.42 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.439 2.093 . . . . 0.0 112.985 -174.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' 3541 ' ' SER . 3.7 pp -156.2 152.74 28.2 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.131 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3541 ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' 3540 ' ' LEU . 38.9 t 169.64 -42.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.549 0.69 . . . . 0.0 109.228 -175.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.15 -8.11 5.92 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.32 -174.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 157.31 -27.66 0.49 Allowed Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.246 -177.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3544 ' ' GLY . . . . . 0.666 ' HA3' ' CZ2' ' A' 3509 ' ' TRP . . . 96.34 97.16 1.83 Allowed Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.453 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.71 147.23 94.99 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.863 2.376 . . . . 0.0 111.961 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.401 ' HA ' ' O ' ' A' 3512 ' ' LEU . 22.0 Cg_endo -62.04 134.84 51.67 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.591 2.194 . . . . 0.0 112.428 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.708 ' HB3' HD13 ' A' 3612 ' ' ILE . 65.4 mt -69.29 109.51 4.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.175 178.16 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.718 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.1 OUTLIER -90.51 134.82 34.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.879 0.371 . . . . 0.0 110.513 -177.784 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.515 HG12 HD11 ' A' 3612 ' ' ILE . 16.9 mt -90.52 107.29 18.3 Favored 'Isoleucine or valine' 0 C--O 1.248 0.997 0 CA-C-O 122.401 1.096 . . . . 0.0 111.061 -177.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.617 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -119.81 10.61 11.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.425 -174.325 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.788 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 32.1 mt-30 -154.49 167.68 29.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.832 -0.167 . . . . 0.0 110.558 179.316 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.41 143.27 14.85 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.869 0.366 . . . . 0.0 111.785 -177.221 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.539 ' O ' ' HA ' ' A' 3608 ' ' ALA . 12.4 tmm? -119.09 134.72 55.03 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.304 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -70.81 109.67 5.13 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.615 ' O ' HD12 ' A' 3555 ' ' LEU . 2.6 pp -74.57 98.23 3.33 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.115 0.96 . . . . 0.0 109.801 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' 3559 ' ' GLN . 19.1 mm-40 -116.36 172.15 7.38 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.296 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.62 68.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.693 0.282 . . . . 0.0 111.268 -176.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 60.1 p -71.11 -37.22 72.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.162 -178.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.492 ' O ' HG23 ' A' 3563 ' ' VAL . 11.7 mm-40 -63.69 -49.51 72.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.536 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3560 ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.09 -35.79 79.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.029 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -66.65 -44.16 82.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.053 0.454 . . . . 0.0 110.586 174.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -52.53 -42.12 57.27 Favored Glycine 0 CA--C 1.518 0.254 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.993 173.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.521 ' O ' ' HG3' ' A' 3567 ' ' MET . 42.7 t -65.82 -49.6 76.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 174.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3564 ' ' ALA . . . . . 0.574 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.08 -27.2 63.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.817 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.545 ' O ' HG22 ' A' 3568 ' ' THR . 0.0 OUTLIER -58.57 -45.57 88.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.88 177.443 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -87.79 -4.44 58.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.074 0.464 . . . . 0.0 110.711 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.574 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 87.6 mtp -85.94 -15.88 40.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.141 178.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3568 ' ' THR . . . . . 0.545 HG22 ' O ' ' A' 3565 ' ' ARG . 11.6 t -85.95 3.13 43.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.11 0.481 . . . . 0.0 110.32 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 20.6 t -117.48 89.61 1.39 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.473 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.14 110.31 3.93 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.532 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.5 m 142.24 -42.97 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.774 1.629 . . . . 0.0 108.279 -177.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.24 -31.16 43.5 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.092 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.691 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -129.85 167.44 18.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.36 -0.382 . . . . 0.0 109.988 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.654 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 49.8 t -128.16 137.15 51.95 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.813 HD22 HD13 ' A' 3642 ' ' LEU . 14.1 tp -106.98 125.97 51.7 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 178.593 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.592 HD11 HD11 ' A' 3661 ' ' ILE . 75.6 mt -127.41 152.42 47.54 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.04 0.448 . . . . 0.0 110.911 -177.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.652 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.35 107.55 13.07 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.52 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.66 119.2 32.93 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.376 0.608 . . . . 0.0 110.339 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.437 ' HG ' HD12 ' A' 3577 ' ' LEU . 48.2 mt -117.19 147.92 41.37 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.251 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3580 ' ' PRO . . . . . 0.457 ' HG2' HD11 ' A' 3653 ' ' ILE . 19.3 Cg_endo -60.45 123.06 12.3 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.234 1.956 . . . . 0.0 111.932 175.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.8 p -117.0 116.53 27.55 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.465 0.65 . . . . 0.0 110.887 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3582 ' ' GLY . . . . . 0.518 ' H ' HG22 ' A' 3588 ' ' VAL . . . -103.66 146.77 16.5 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.948 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -62.78 -36.22 82.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.594 0.711 . . . . 0.0 109.226 178.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.6 ' O ' HG23 ' A' 3588 ' ' VAL . 16.9 t70 -131.23 166.17 21.75 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -55.85 -39.12 70.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.833 0.349 . . . . 0.0 110.648 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -66.42 -42.5 87.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.998 0.427 . . . . 0.0 110.37 177.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.484 ' HB3' ' H ' ' A' 3584 ' ' ASP . 24.1 t70 -61.42 -38.52 87.44 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.152 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' 3584 ' ' ASP . 78.9 t -56.33 -47.41 81.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.44 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 83.0 t -59.42 -47.43 90.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.324 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 36.1 t -60.65 -45.5 93.86 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.162 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3591 ' ' GLN . . . . . 1.009 HE22 ' HB1' ' A' 3520 ' ' ALA . 25.9 tp60 -67.56 -41.58 83.98 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.826 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3592 ' ' THR . . . . . 0.514 ' O ' ' HG3' ' A' 3596 ' ' LYS . 87.7 m -57.6 -52.37 65.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.516 0.198 . . . . 0.0 110.991 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.549 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 12.2 pt-20 -65.13 -31.13 72.16 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.759 0.314 . . . . 0.0 111.32 -178.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 48.9 m -68.71 -48.62 63.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.848 0.356 . . . . 0.0 110.38 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.621 HD12 ' HB2' ' A' 3599 ' ' PHE . 55.9 tp -62.19 -41.89 98.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.843 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.549 ' HE2' ' HA ' ' A' 3593 ' ' GLU . 53.4 mtmt -57.77 -48.16 80.46 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.008 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -75.85 -39.57 56.33 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.537 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -86.97 -46.77 9.54 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -169.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.621 ' HB2' HD12 ' A' 3595 ' ' LEU . 17.4 m-85 -99.51 -50.45 4.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.818 0.342 . . . . 0.0 111.283 -177.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.538 ' HB ' ' O ' ' A' 3596 ' ' LYS . 31.1 mm -61.07 -55.84 21.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.69 -175.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 48.0 m -60.48 -45.94 91.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.248 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.725 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -60.14 -52.28 66.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.724 0.297 . . . . 0.0 110.648 179.193 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.725 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -67.78 -34.1 76.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.785 0.326 . . . . 0.0 110.833 -170.984 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -76.62 -38.89 53.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.139 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.94 -41.12 78.49 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 120.804 0.335 . . . . 0.0 110.936 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -78.32 -10.45 59.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.395 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3607 ' ' GLN . . . . . 0.411 ' O ' ' HG ' ' A' 3555 ' ' LEU . 43.0 mt-30 55.17 47.93 20.64 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.334 0.396 . . . . 0.0 111.017 178.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -133.88 171.43 14.19 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -171.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -104.4 117.82 35.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.213 170.211 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -67.78 104.37 1.15 Allowed Glycine 0 C--O 1.222 -0.598 0 C-N-CA 120.636 -0.793 . . . . 0.0 111.702 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.788 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 31.9 mm -90.38 131.24 38.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.073 0.463 . . . . 0.0 111.14 -174.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.708 HD13 ' HB3' ' A' 3547 ' ' LEU . 55.3 mt -131.46 108.83 15.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.039 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.688 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.0 m120 -81.06 136.47 35.96 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.25 0.547 . . . . 0.0 111.033 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.652 HG11 ' O ' ' A' 3537 ' ' SER . 21.3 t -128.55 136.21 28.77 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.807 -177.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.523 ' HA ' ' O ' ' A' 3621 ' ' GLN . 96.9 Cg_endo -83.46 135.82 7.26 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.199 1.933 . . . . 0.0 112.091 171.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.645 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 26.4 t-20 -67.8 129.16 93.4 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.409 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -57.08 108.07 0.33 Allowed 'Trans proline' 0 CA--C 1.53 0.282 0 C-N-CA 122.844 2.363 . . . . 0.0 112.702 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 107.32 -33.56 6.29 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.128 -0.558 . . . . 0.0 112.088 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3619 ' ' SER . . . . . 0.419 ' HB3' ' HB3' ' A' 3616 ' ' ASN . 30.9 t -95.89 -30.08 13.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.838 0.352 . . . . 0.0 110.45 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 65.4 t30 67.14 12.44 8.96 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.417 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.549 ' HG2' ' H ' ' A' 3623 ' ' ALA . 28.0 tt0 -68.82 110.66 6.37 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.451 177.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.467 ' HA ' ' O ' ' A' 3614 ' ' VAL . 88.8 Cg_endo -84.1 22.96 0.87 Allowed 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.734 2.289 . . . . 0.0 112.506 -177.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3623 ' ' ALA . . . . . 0.549 ' H ' ' HG2' ' A' 3621 ' ' GLN . . . -83.26 46.95 1.18 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.296 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.688 ' O ' ' HA ' ' A' 3613 ' ' ASN . 62.0 m-85 -127.06 133.54 50.45 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.132 175.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.459 HG13 HG23 ' A' 3611 ' ' ILE . 3.8 t -125.2 113.71 36.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.003 177.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.636 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -96.74 112.19 24.05 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 169.576 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3627 ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -94.51 110.57 22.36 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -178.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.594 HG12 HG12 ' A' 3659 ' ' ILE . 32.9 mt -90.98 99.26 9.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.993 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3629 ' ' PHE . . . . . 0.444 ' CE1' ' HB2' ' A' 3609 ' ' ALA . 78.3 m-85 -89.83 138.44 27.88 Favored Pre-proline 0 C--N 1.318 -0.778 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.12 178.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.597 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 36.4 Cg_endo -65.53 169.57 12.49 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.556 2.171 . . . . 0.0 111.113 175.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.0 53.45 1.53 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 122.703 2.269 . . . . 0.0 112.51 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 26.0 p -81.03 162.63 23.71 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.429 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -52.2 -41.06 62.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.542 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 26.4 t80 -57.46 -44.73 85.03 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 14.6 m -61.58 -58.47 7.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.77 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -60.16 -37.87 81.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.465 -174.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 39.6 m -66.81 -49.97 64.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.838 0.352 . . . . 0.0 110.74 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -65.38 -32.63 74.37 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.554 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 50.8 mt -63.5 -35.19 79.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.365 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.661 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 19.3 t -72.04 -33.33 67.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.049 0.452 . . . . 0.0 110.148 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -78.97 -30.65 44.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.02 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.813 HD13 HD22 ' A' 3575 ' ' LEU . 22.4 mt -93.49 -38.84 11.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.893 -177.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -144.64 74.93 14.94 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -176.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3644 ' ' PRO . . . . . 0.44 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 36.5 Cg_endo -66.58 -17.8 53.38 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 122.485 2.123 . . . . 0.0 112.324 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3645 ' ' ASP . . . . . 0.598 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.3 m-20 -72.66 -50.01 27.89 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.338 -177.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.652 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -82.56 -27.04 31.85 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 178.38 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.661 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -53.49 -42.99 67.85 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.156 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -65.18 -17.97 64.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.635 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.688 ' HB3' HG13 ' A' 3496 ' ' VAL . 15.0 m -89.75 -34.19 16.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.923 0.392 . . . . 0.0 110.72 177.267 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.717 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.4 pt -85.52 -13.37 11.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -174.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 12.0 p -56.72 -31.31 64.4 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.192 0.52 . . . . 0.0 110.464 175.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 9.4 t30 -83.31 -36.74 24.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.673 174.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.717 HG22 ' HA ' ' A' 3650 ' ' ILE . 20.8 tt -104.59 45.17 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 122.741 1.258 . . . . 0.0 110.103 -177.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.471 ' N ' ' HD2' ' A' 3655 ' ' PRO . 19.9 m -33.7 -42.0 0.36 Allowed Pre-proline 0 CA--C 1.541 0.624 0 CA-C-N 113.403 -1.726 . . . . 0.0 113.845 166.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.517 ' HD2' ' C ' ' A' 3653 ' ' ILE . 23.6 Cg_endo -65.02 84.16 0.18 Allowed 'Trans proline' 0 C--N 1.359 1.123 0 CA-C-N 120.532 1.226 . . . . 0.0 111.715 173.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 28.6 p80 -152.15 173.35 15.06 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.137 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.423 HD22 HG22 ' A' 3628 ' ' ILE . 35.4 mt -121.98 142.27 50.49 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.165 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.6 ttp -105.16 111.23 23.9 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 176.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.843 HD12 HD21 ' A' 3524 ' ' LEU . 85.5 mt -103.61 119.59 52.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.264 0.554 . . . . 0.0 111.381 -172.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.691 HG13 ' HD2' ' A' 3573 ' ' TYR . 87.1 t -106.35 113.31 42.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.859 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.654 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 46.8 mt -91.02 113.7 27.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.082 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.58 129.22 56.14 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.71 0.291 . . . . 0.0 111.503 -178.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 4.7 m -71.65 116.54 12.14 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 172.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 45.7 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.527 -0.749 . . . . 0.0 110.567 -177.578 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.525 ' CD1' ' HB2' ' A' 3553 ' ' MET . 22.9 m-85 . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 120.48 0.181 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.912 ' HG3' ' H ' ' B' 2520 ' ' THR . 2.4 tp10 57.69 -159.19 0.26 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.884 0.373 . . . . 0.0 110.281 175.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.912 ' H ' ' HG3' ' B' 2519 ' ' GLU . 89.5 m -150.75 133.7 15.95 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 171.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.617 ' H ' ' C ' ' A' 3550 ' ' ALA . 35.7 tp -89.52 -121.05 0.06 Allowed 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.301 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.812 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B 2523 ' ' ASP . . . . . 0.557 ' HB2' ' H ' ' A' 3516 ' ' LYS . 43.5 t0 -163.13 96.32 0.88 Allowed 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 173.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.546 -177.781 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 3496 ' ' VAL . . . . . . . . . . . . . 34.7 m . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 120.981 0.42 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 22.2 t70 -107.04 152.53 23.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.483 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 2.8 tpp -63.38 -28.9 70.31 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -175.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 77.4 t -58.54 -24.53 25.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 CA-C-O 120.949 0.404 . . . . 0.0 111.925 -175.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -83.09 -57.57 3.22 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.399 177.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.576 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp -63.5 -35.69 81.29 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -173.482 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.633 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -68.12 -16.38 63.98 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.417 -172.307 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.633 ' N ' HD13 ' A' 3502 ' ' LEU . 0.7 OUTLIER -78.2 -21.03 50.67 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.18 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -98.7 -43.0 6.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.356 0.598 . . . . 0.0 109.74 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.709 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -147.51 100.15 3.81 Favored Pre-proline 0 N--CA 1.444 -0.739 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.773 179.934 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -82.71 173.89 10.03 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 123.985 3.123 . . . . 0.0 113.693 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.575 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 90.3 mt -71.23 133.73 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.047 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.463 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.0 m -101.95 -30.0 3.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.481 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.778 ' HE3' HD12 ' A' 3524 ' ' LEU . 26.1 t90 -147.04 154.64 41.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.652 0.263 . . . . 0.0 110.373 -174.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -150.59 121.55 7.66 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -175.78 -129.33 1.2 Allowed Glycine 0 N--CA 1.441 -0.976 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -178.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.644 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -140.13 152.18 45.9 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.076 0.465 . . . . 0.0 111.07 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.473 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.0 mt -105.69 149.72 26.12 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 168.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.55 125.97 14.02 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -177.192 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.644 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.86 144.89 41.63 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 172.932 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.644 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.3 OUTLIER 62.63 -90.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.051 0.54 . . . . 0.0 110.337 -169.989 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -148.65 12.97 0.91 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.45 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.41 ' O ' ' HA ' ' A' 3514 ' ' ALA . 20.8 m-20 -106.01 144.06 33.26 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.76 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.514 HG22 ' HB2' ' A' 3514 ' ' ALA . 20.0 p -125.94 143.6 51.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.473 -177.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.67 115.06 13.36 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.256 174.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.644 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.44 116.34 12.77 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.956 0.407 . . . . 0.0 109.913 179.007 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.422 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -128.57 148.0 33.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 121.607 0.718 . . . . 0.0 111.75 -175.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -109.26 125.36 52.19 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.854 173.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.842 HD21 HD12 ' A' 3659 ' ' ILE . 1.0 OUTLIER -94.51 112.42 24.19 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.39 0.614 . . . . 0.0 111.86 -174.784 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.575 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 62.9 m-70 -88.15 138.53 31.36 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.799 176.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.709 ' O ' ' HB2' ' A' 3505 ' ' TYR . 66.2 t80 -67.28 138.18 56.66 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 174.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.559 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.3 t -114.99 -58.38 3.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.177 0.513 . . . . 0.0 110.971 177.484 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.508 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 58.3 m -160.2 171.4 19.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.537 -171.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.61 -148.96 20.26 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.125 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.552 ' HB2' ' HA ' ' A' 3571 ' ' THR . 44.0 t-20 -108.23 118.53 37.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.945 0.402 . . . . 0.0 110.117 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.8 p30 -63.34 -28.21 69.85 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.907 -174.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 57.5 t -60.88 -33.47 55.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.752 0.311 . . . . 0.0 110.722 -177.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.536 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 19.7 mt -57.65 -42.68 83.97 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.076 177.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.401 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -68.38 -38.44 81.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.881 0.372 . . . . 0.0 110.907 -178.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 29.8 t60 -66.17 -36.48 83.22 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.612 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -89.73 -6.29 56.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3537 ' ' SER . . . . . . . . . . . . . 20.5 p -104.04 -43.34 5.3 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 122.005 -0.434 . . . . 0.0 111.271 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.662 HD13 ' HB2' ' A' 3509 ' ' TRP . 22.4 mt -79.36 110.81 16.5 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.982 0.42 . . . . 0.0 110.196 -173.591 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3539 ' ' PRO . . . . . 0.508 ' HD3' HG21 ' A' 3614 ' ' VAL . 36.6 Cg_endo -70.31 150.8 65.41 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.965 2.443 . . . . 0.0 112.87 -174.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 1.4 pp -167.46 155.27 9.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.386 177.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 19.6 m -155.86 -45.11 0.08 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.319 175.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.81 -23.67 12.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.957 -1.019 . . . . 0.0 110.346 176.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 176.71 -42.06 0.1 Allowed Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 114.803 -1.09 . . . . 0.0 111.402 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 151.03 116.68 0.75 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.459 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.49 ' HD2' ' O ' ' A' 3539 ' ' PRO . 74.4 Cg_endo -79.03 153.79 25.29 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 123.045 2.497 . . . . 0.0 112.108 177.133 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.622 ' HA ' ' O ' ' A' 3512 ' ' LEU . 29.0 Cg_endo -62.65 120.02 7.36 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.675 2.25 . . . . 0.0 113.211 -177.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.733 ' HB3' HD13 ' A' 3612 ' ' ILE . 39.1 mt -69.27 118.64 12.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.834 174.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -99.22 139.23 35.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 111.643 -174.342 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.407 ' CG2' HD13 ' B' 2521 ' ' LEU . 25.9 mt -95.6 107.83 20.16 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 121.603 0.716 . . . . 0.0 111.609 -175.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.607 ' HB1' ' HB2' ' B' 2525 ' ' GLU . . . -118.08 1.98 12.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.002 -175.59 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.667 ' HA ' ' HA ' ' B' 2520 ' ' THR . 62.4 mt-30 -145.64 171.43 14.73 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.527 -0.175 . . . . 0.0 110.527 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.792 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.2 138.89 11.66 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 120.73 0.3 . . . . 0.0 111.172 -179.691 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.572 ' HG3' ' CE1' ' B' 2518 ' ' TYR . 10.8 tmm? -109.67 132.27 54.3 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.116 -0.233 . . . . 0.0 110.885 -178.11 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3554 ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' 3554 ' ' ARG . 0.1 OUTLIER -63.71 109.03 1.57 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.181 -179.426 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.554 ' HB2' HD21 ' A' 3560 ' ' LEU . 3.5 pp -81.95 97.27 8.0 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 122.754 1.264 . . . . 0.0 109.411 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.56 ' H ' ' HB2' ' A' 3559 ' ' GLN . 13.9 mm-40 -111.4 166.49 11.08 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.741 -1.572 . . . . 0.0 108.855 177.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.503 ' O ' ' HG3' ' A' 3561 ' ' GLU . . . -54.02 -52.39 60.97 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.973 0.416 . . . . 0.0 111.038 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 25.5 p -65.6 -40.1 92.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.138 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.56 ' HB2' ' H ' ' A' 3556 ' ' GLU . 15.9 mm100 -65.03 -40.45 94.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.276 -179.089 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' 3555 ' ' LEU . 98.5 mt -62.85 -37.94 88.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.772 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' 3557 ' ' ALA . 12.8 mt-10 -68.65 -33.22 73.63 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 175.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3562 ' ' GLY . . . . . 0.481 ' O ' ' HB3' ' A' 3565 ' ' ARG . . . -64.75 -33.52 87.44 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.647 173.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.564 ' O ' ' HG2' ' A' 3566 ' ' ARG . 56.4 t -70.69 -45.75 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 174.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3564 ' ' ALA . . . . . 0.549 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.54 -27.03 64.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.122 178.736 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.481 ' HB3' ' O ' ' A' 3562 ' ' GLY . 75.5 ttt180 -55.3 -45.02 76.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.178 177.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3566 ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' 3563 ' ' VAL . 9.2 ptp180 -87.2 -14.7 40.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.961 0.41 . . . . 0.0 110.844 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.549 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 78.0 mtp -83.3 -20.1 35.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.537 -176.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 11.2 t -88.1 4.04 46.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.959 0.409 . . . . 0.0 110.842 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 46.4 t -127.39 102.65 9.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-O 121.05 0.452 . . . . 0.0 110.748 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3570 ' ' GLU . . . . . 0.571 ' O ' ' HB ' ' A' 3571 ' ' THR . 1.7 mp0 -62.01 139.8 58.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.074 177.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.571 ' HB ' ' O ' ' A' 3570 ' ' GLU . 73.4 m 95.1 -27.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 O-C-N 124.199 0.937 . . . . 0.0 110.069 179.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.01 -31.57 50.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.72 171.326 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.731 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -138.28 167.17 22.42 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.048 177.708 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.643 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 29.4 t -129.11 135.99 49.62 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 171.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.759 HD22 HD13 ' A' 3642 ' ' LEU . 13.9 tp -106.58 126.31 52.11 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.614 HD11 HD11 ' A' 3661 ' ' ILE . 82.4 mt -128.17 151.79 48.82 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.596 -178.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.628 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -118.76 109.11 15.68 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.915 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.549 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.08 119.05 32.39 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.406 0.622 . . . . 0.0 110.469 -177.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.451 ' HG ' HD12 ' A' 3577 ' ' LEU . 82.9 mt -121.57 142.31 35.42 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.73 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.48 134.94 61.47 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.234 1.956 . . . . 0.0 111.359 177.077 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.2 p -124.52 114.53 19.55 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.142 0.496 . . . . 0.0 110.461 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3582 ' ' GLY . . . . . 0.404 ' HA2' ' OD2' ' A' 3587 ' ' ASP . . . -104.23 146.33 16.25 Favored Glycine 0 N--CA 1.443 -0.851 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.588 -178.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 13.1 mtm-85 -62.55 -48.87 77.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.757 0.789 . . . . 0.0 109.359 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.589 ' O ' HG23 ' A' 3588 ' ' VAL . 5.0 m-20 -125.87 174.95 8.01 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.177 -176.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -53.48 -48.4 68.95 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.347 0.404 . . . . 0.0 110.886 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -64.76 -38.96 92.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.58 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.446 ' HB3' ' H ' ' A' 3584 ' ' ASP . 27.8 t70 -65.15 -41.91 94.28 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.218 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' 3584 ' ' ASP . 79.2 t -57.25 -43.61 82.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.501 176.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 11.7 t -62.49 -50.91 77.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.481 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 6.0 m -55.83 -48.58 75.2 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.363 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -64.28 -41.71 96.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.577 0.227 . . . . 0.0 110.848 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3592 ' ' THR . . . . . 0.445 ' O ' ' HG3' ' A' 3596 ' ' LYS . 28.8 m -62.06 -43.84 97.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.033 0.444 . . . . 0.0 109.876 176.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -59.67 -51.08 71.32 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.98 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 32.4 m -59.37 -44.97 92.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.686 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.5 HD12 ' HB2' ' A' 3599 ' ' PHE . 48.0 tp -62.38 -43.34 99.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.917 -178.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.516 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 55.4 mtmt -59.68 -51.73 68.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.624 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -69.77 -33.63 72.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.291 -175.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -95.45 -46.78 6.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -171.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.5 ' HB2' HD12 ' A' 3595 ' ' LEU . 27.3 m-85 -100.3 -51.03 3.75 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 -174.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.516 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.9 mm -62.38 -60.54 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.359 -173.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 88.0 m -58.0 -39.71 78.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.394 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.438 ' HE1' HD11 ' B' 2521 ' ' LEU . 45.6 t80 -71.74 -56.15 6.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.529 -176.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' 3608 ' ' ALA . 0.3 OUTLIER -56.24 -39.81 73.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.726 -0.216 . . . . 0.0 111.329 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -75.88 -30.52 58.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.766 0.317 . . . . 0.0 110.297 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -65.79 -38.69 89.7 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.408 0.623 . . . . 0.0 110.248 176.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -79.5 -18.9 50.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.953 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3607 ' ' GLN . . . . . 0.443 ' O ' ' HG ' ' A' 3555 ' ' LEU . 52.5 mt-30 51.26 51.11 17.6 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -170.028 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.553 ' O ' HD12 ' A' 3603 ' ' LEU . . . -133.23 -177.68 4.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.739 -174.249 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.792 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -117.7 118.33 31.8 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.131 176.103 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3610 ' ' GLY . . . . . 0.511 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.2 104.18 0.85 Allowed Glycine 0 C--O 1.223 -0.548 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.492 178.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.666 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 37.3 mm -90.0 123.36 42.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.188 0.518 . . . . 0.0 110.95 -175.714 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.733 HD13 ' HB3' ' A' 3547 ' ' LEU . 40.6 mt -118.52 105.96 18.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.83 175.318 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.465 ' HA ' ' O ' ' A' 3624 ' ' TYR . 11.7 m120 -84.74 109.33 17.97 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.233 178.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.508 HG21 ' HD3' ' A' 3539 ' ' PRO . 10.7 p -116.2 136.8 23.09 Favored Pre-proline 0 C--N 1.314 -0.975 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.982 -172.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.523 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 60.6 Cg_endo -75.94 141.18 23.75 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.374 2.05 . . . . 0.0 113.012 176.325 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.524 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 6.9 t30 -73.14 121.87 86.2 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.055 176.26 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.45 128.5 15.08 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.653 2.902 . . . . 0.0 113.085 -177.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 96.2 -36.55 3.8 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.1 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 33.2 t -98.95 -28.52 13.39 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.614 0.245 . . . . 0.0 110.662 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3620 ' ' ASN . . . . . 0.512 ' HA ' ' HB2' ' A' 3615 ' ' PRO . 35.5 m-20 62.6 21.32 12.6 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.099 -176.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.509 ' OE1' ' HD2' ' A' 3622 ' ' PRO . 6.5 tp-100 -85.85 108.32 16.32 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.806 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.523 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 74.9 Cg_endo -76.64 24.58 0.46 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.339 2.692 . . . . 0.0 113.479 -176.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -77.4 48.77 0.67 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.033 0.444 . . . . 0.0 111.564 -177.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.524 ' HE2' ' HB2' ' A' 3616 ' ' ASN . 70.7 m-85 -139.34 133.86 31.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.082 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.443 HG13 HD12 ' A' 3611 ' ' ILE . 4.1 t -117.14 115.64 49.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.166 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.635 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -99.31 112.96 25.02 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 170.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.429 ' O ' ' HA ' ' A' 3659 ' ' ILE . 13.5 mt-30 -94.16 111.06 22.76 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.664 -177.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.608 HG12 HG12 ' A' 3659 ' ' ILE . 47.3 mt -93.97 99.46 9.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.548 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -91.17 138.49 25.79 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.451 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.34 168.32 22.65 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.786 2.324 . . . . 0.0 111.677 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -64.81 81.52 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.805 2.337 . . . . 0.0 112.243 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 7.9 p -111.84 162.08 15.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.017 -176.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3633 ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' 3633 ' ' GLU . 1.7 mp0 -54.72 -37.84 66.35 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.151 -179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3634 ' ' PHE . . . . . 0.433 ' CE2' ' HB3' ' A' 3560 ' ' LEU . 31.9 t80 -65.87 -42.78 89.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.097 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 67.1 p -62.86 -54.08 44.27 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.968 -178.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3636 ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' 3633 ' ' GLU . 0.6 OUTLIER -59.55 -38.14 80.29 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.643 0.258 . . . . 0.0 111.375 -179.364 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 48.1 t -56.71 -53.19 60.63 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.816 178.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -74.3 -30.57 62.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.949 -178.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3639 ' ' LEU . . . . . 0.472 ' HB3' HD23 ' A' 3647 ' ' LEU . 49.2 mt -62.53 -39.64 94.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.444 0.164 . . . . 0.0 110.891 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.537 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 24.3 m -63.97 -39.66 94.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.198 0.523 . . . . 0.0 110.54 177.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -72.07 -43.4 64.94 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.675 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.759 HD13 HD22 ' A' 3575 ' ' LEU . 20.0 mt -83.5 -42.03 17.33 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.442 -173.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.437 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -142.63 83.5 11.7 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.828 0.347 . . . . 0.0 111.438 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.73 -26.03 28.14 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.666 2.244 . . . . 0.0 113.307 -175.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 5.6 t0 -71.84 -47.83 50.38 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -173.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.628 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.03 -29.37 49.35 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.359 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.537 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.14 -51.58 63.81 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.892 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.03 -25.4 66.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.933 0.397 . . . . 0.0 111.136 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 17.6 m -79.36 -36.35 39.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.029 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.573 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.4 pt -81.42 -10.44 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.237 0 CA-C-O 120.755 0.312 . . . . 0.0 111.349 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 9.4 t -59.08 -26.53 64.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.142 0.496 . . . . 0.0 109.701 174.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 13.9 m120 -79.68 -41.21 27.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.326 0.584 . . . . 0.0 110.111 175.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.573 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.6 tp -105.29 40.32 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 122.22 1.01 . . . . 0.0 109.821 -177.343 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.5 ' N ' ' HD2' ' A' 3655 ' ' PRO . 50.8 m -40.43 -40.61 2.08 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-N 114.521 -1.218 . . . . 0.0 113.6 173.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' 3654 ' ' SER . 14.9 Cg_endo -60.24 78.57 0.07 OUTLIER 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 121.568 1.512 . . . . 0.0 111.864 169.065 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3656 ' ' HIS . . . . . 0.43 ' CB ' HD23 ' A' 3579 ' ' LEU . 32.6 p80 -150.46 -178.64 6.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.636 -179.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.482 ' HB3' HG23 ' A' 3628 ' ' ILE . 24.0 mt -124.74 142.59 51.3 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.71 -178.482 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 61.2 ttp -102.69 110.99 23.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.842 HD12 HD21 ' A' 3524 ' ' LEU . 84.0 mt -103.88 121.29 55.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-O 121.306 0.574 . . . . 0.0 111.492 -173.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.731 HG13 ' HD2' ' A' 3573 ' ' TYR . 85.1 t -107.27 116.4 50.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.661 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.643 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 64.3 mt -90.81 112.19 24.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 177.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -108.52 128.52 54.88 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.881 0.372 . . . . 0.0 111.322 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 9.2 m -68.95 114.63 7.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.005 174.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 63.2 t . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.914 -0.565 . . . . 0.0 110.155 179.196 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.572 ' CE1' ' HG3' ' A' 3553 ' ' MET . 8.0 m-85 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 111.172 0.064 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.596 ' HG2' ' H ' ' B' 2520 ' ' THR . 15.7 tt0 57.01 -158.74 0.26 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 177.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.667 ' HA ' ' HA ' ' A' 3551 ' ' GLN . 8.0 t -157.44 124.55 5.13 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 172.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.664 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.4 OUTLIER -82.02 -129.15 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.51 ' N ' HD23 ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 24.9 t70 -166.0 -70.12 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.683 178.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B 2525 ' ' GLU . . . . . 0.607 ' HB2' ' HB1' ' A' 3550 ' ' ALA . 38.8 mt-10 . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.447 -0.787 . . . . 0.0 110.363 177.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.593 ' HA ' ' HA ' ' A' 3649 ' ' SER . 8.8 p . . . . . 0 N--CA 1.483 1.185 0 CA-C-O 121.473 0.654 . . . . 0.0 110.494 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3497 ' ' ASP . . . . . 0.477 ' OD2' ' HG3' ' A' 3500 ' ' GLN . 29.0 t70 -79.57 121.13 24.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.245 -174.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3498 ' ' MET . . . . . 0.511 ' HA ' ' CD2' ' A' 3501 ' ' LEU . 69.6 mtm -82.7 -13.1 56.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.858 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.401 ' HA ' HD12 ' A' 3502 ' ' LEU . 45.6 t -73.8 -23.88 19.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.311 0.577 . . . . 0.0 111.092 -176.474 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3500 ' ' GLN . . . . . 0.477 ' HG3' ' OD2' ' A' 3497 ' ' ASP . 54.0 mt-30 -80.17 -48.11 13.66 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 122.085 -0.385 . . . . 0.0 110.507 176.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.611 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.3 pp -66.05 -37.18 85.18 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -174.019 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.666 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -71.82 -13.65 61.75 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.429 -173.301 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.543 ' N ' HD13 ' A' 3502 ' ' LEU . 51.4 tptt -67.64 -23.7 65.37 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 174.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 36.0 mmtm -103.27 -42.66 5.67 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.261 176.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.684 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -146.87 103.08 3.88 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-O 121.471 0.653 . . . . 0.0 110.796 179.252 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 3506 ' ' PRO . . . . . 0.666 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 94.0 Cg_endo -82.11 174.39 10.1 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 123.972 3.115 . . . . 0.0 113.556 -176.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.518 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 82.1 mt -71.22 133.12 32.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.536 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.475 HG13 ' HB2' ' A' 3526 ' ' PHE . 33.8 m -101.89 -24.55 4.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.364 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.638 ' HB2' HD13 ' A' 3538 ' ' LEU . 50.4 t-105 -156.13 154.73 31.34 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.805 0.336 . . . . 0.0 110.786 -176.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -147.57 120.08 8.5 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -171.1 -132.92 1.54 Allowed Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.723 -177.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.574 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -139.83 149.0 42.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.182 0.515 . . . . 0.0 111.546 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.486 HD23 ' HB2' ' A' 3547 ' ' LEU . 93.8 mt -105.1 144.38 31.97 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 170.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.696 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -141.98 124.44 15.74 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.738 0.304 . . . . 0.0 111.61 -177.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.67 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.31 146.37 44.54 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 173.903 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.67 ' CD ' HD12 ' A' 3515 ' ' LEU . 1.2 mptm? 62.64 -93.69 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -167.066 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 22.4 m120 -147.26 11.95 1.04 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.343 175.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' 3514 ' ' ALA . 3.9 t0 -100.09 138.72 36.78 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.129 -175.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.615 HG22 ' HB2' ' A' 3514 ' ' ALA . 28.0 p -123.58 127.69 48.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.087 0.47 . . . . 0.0 111.88 -175.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -120.71 115.64 23.72 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.395 175.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.574 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.75 120.78 18.85 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.429 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -130.38 147.93 33.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.538 0.685 . . . . 0.0 111.834 -175.255 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -111.1 126.09 54.46 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.986 173.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.938 HD21 HD12 ' A' 3659 ' ' ILE . 0.8 OUTLIER -95.51 112.63 24.31 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.34 0.59 . . . . 0.0 111.986 -173.999 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.518 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 74.9 m-70 -85.53 140.28 30.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.757 174.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.684 ' O ' ' HB2' ' A' 3505 ' ' TYR . 58.9 t80 -70.17 136.64 50.28 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 175.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.598 ' CG1' HD23 ' A' 3575 ' ' LEU . 19.6 t -115.36 -51.96 4.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.081 0.467 . . . . 0.0 111.372 178.04 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 25.8 t -162.19 170.39 19.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.706 -170.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.25 -149.21 21.19 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.854 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.544 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.5 t-20 -104.7 117.02 33.05 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.773 0.32 . . . . 0.0 110.713 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 12.2 p30 -61.15 -36.28 79.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3532 ' ' VAL . . . . . 0.446 HG12 ' HD2' ' A' 3536 ' ' ARG . 57.8 t -59.95 -33.41 52.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.559 0.218 . . . . 0.0 110.489 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.54 HD23 ' HD3' ' A' 3536 ' ' ARG . 16.4 mt -56.7 -40.99 76.6 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.235 178.054 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.453 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.81 -47.26 72.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.885 0.374 . . . . 0.0 110.378 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -59.89 -35.59 75.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.946 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.54 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.4 ptm180 -88.95 -11.09 45.37 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.02 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.523 ' O ' HG21 ' A' 3614 ' ' VAL . 57.5 p -103.05 -37.52 7.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.976 0.417 . . . . 0.0 111.227 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.638 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.3 mt -78.88 112.01 24.14 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -174.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -66.45 139.84 55.48 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 123.255 2.636 . . . . 0.0 113.989 -166.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 2.3 pp -156.77 153.13 27.85 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.161 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 51.0 m -164.82 -46.61 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.44 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -116.15 -47.37 2.77 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.718 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . -147.75 -58.44 0.01 OUTLIER Glycine 0 C--N 1.311 -0.856 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.617 178.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 161.02 99.18 0.14 Allowed Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.234 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -72.42 141.93 36.01 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.459 2.106 . . . . 0.0 111.2 176.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.41 143.2 62.61 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.625 2.217 . . . . 0.0 112.614 -176.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.707 ' HB3' HD13 ' A' 3612 ' ' ILE . 57.0 mt -78.0 118.05 19.91 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.264 177.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.696 ' HA ' ' O ' ' A' 3514 ' ' ALA . 23.8 ptt180 -103.52 141.62 35.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.074 0.464 . . . . 0.0 111.401 -177.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.481 HD12 HD22 ' A' 3515 ' ' LEU . 19.5 mt -94.12 107.23 19.04 Favored 'Isoleucine or valine' 0 C--O 1.254 1.326 0 CA-C-O 122.705 1.24 . . . . 0.0 111.648 -172.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.468 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -108.94 -6.52 15.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.891 -173.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.686 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 52.6 mt-30 -148.29 176.95 9.83 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.363 0.125 . . . . 0.0 111.142 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -155.83 136.79 13.62 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.884 0.374 . . . . 0.0 111.585 -178.945 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.603 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 14.1 tmm? -110.39 121.67 45.85 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.398 177.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -71.78 110.64 6.45 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.549 ' HB2' HD21 ' A' 3560 ' ' LEU . 2.9 pp -71.98 98.65 2.09 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 122.278 1.037 . . . . 0.0 110.054 -176.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.612 ' O ' ' HG ' ' A' 3560 ' ' LEU . 43.4 mt-10 -113.09 166.42 11.45 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.309 176.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -53.24 -47.48 68.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.063 0.459 . . . . 0.0 111.11 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 1.6 p -63.04 -38.39 91.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.507 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.551 ' O ' HG23 ' A' 3563 ' ' VAL . 20.0 mm-40 -74.27 -37.59 63.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.168 -177.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' 3556 ' ' GLU . 86.0 mt -61.72 -35.32 77.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.729 0.3 . . . . 0.0 110.488 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -62.85 -46.17 89.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.961 173.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -62.32 -34.07 88.1 Favored Glycine 0 CA--C 1.519 0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.499 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.565 ' O ' ' HG3' ' A' 3567 ' ' MET . 59.2 t -66.87 -49.5 73.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.287 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3564 ' ' ALA . . . . . 0.566 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.74 -27.54 68.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.063 178.298 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -54.76 -47.34 74.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.533 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.2 ptp85 -85.17 -14.41 47.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.078 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.566 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 87.6 mtp -83.08 -19.58 36.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.804 0.335 . . . . 0.0 111.153 -179.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3568 ' ' THR . . . . . 0.43 HG23 ' O ' ' A' 3564 ' ' ALA . 37.0 p -80.36 -21.45 42.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.144 0.497 . . . . 0.0 110.549 177.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 23.3 t -106.19 78.65 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.572 177.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.66 108.21 1.99 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.665 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.544 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.7 m 155.96 -45.85 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.373 1.469 . . . . 0.0 107.732 -173.171 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -86.76 -14.86 41.11 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.295 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.656 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -134.81 162.88 31.12 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.758 175.475 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.622 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 34.2 t -128.23 133.94 48.92 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.312 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.783 HD22 HD13 ' A' 3642 ' ' LEU . 12.6 tp -105.61 125.41 50.96 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.588 HD11 HD11 ' A' 3661 ' ' ILE . 81.4 mt -125.78 154.52 42.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.85 -177.024 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.722 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.72 108.14 13.62 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.186 179.76 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.451 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.28 123.64 37.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.236 0.541 . . . . 0.0 110.591 -178.08 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.414 HD23 ' HB2' ' A' 3656 ' ' HIS . 73.7 mt -124.63 143.71 44.22 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.258 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.47 117.96 4.78 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.46 2.107 . . . . 0.0 112.21 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.7 p -110.08 119.62 39.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.127 0.489 . . . . 0.0 110.029 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -102.82 145.19 16.27 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.735 -177.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 44.3 mtm180 -70.52 -25.18 63.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.782 0.801 . . . . 0.0 109.87 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.576 ' O ' HG23 ' A' 3588 ' ' VAL . 23.9 t70 -147.9 169.95 18.72 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.354 -1.294 . . . . 0.0 108.257 -175.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.53 -49.59 67.3 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.042 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -60.93 -37.96 84.14 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.688 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.556 ' HB3' ' H ' ' A' 3584 ' ' ASP . 6.4 t70 -66.97 -40.83 87.53 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.548 -177.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' 3584 ' ' ASP . 94.1 t -58.68 -39.49 76.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.178 0.514 . . . . 0.0 110.385 178.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 3.0 t -63.49 -48.27 87.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.457 177.547 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 71.9 m -58.72 -47.31 85.02 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 114.178 -1.374 . . . . 0.0 111.703 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3591 ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' 3587 ' ' ASP . 71.6 mm-40 -63.87 -45.08 91.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.478 0.18 . . . . 0.0 110.758 -179.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 46.3 m -57.59 -47.4 82.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.16 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.42 ' HA ' ' HE3' ' A' 3596 ' ' LYS . 9.5 tp10 -60.91 -50.7 72.37 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.887 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 19.4 m -60.65 -45.25 94.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.187 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.529 HD12 ' HB2' ' A' 3599 ' ' PHE . 44.8 tp -64.08 -45.93 86.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.568 -175.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.785 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -71.29 -25.55 62.49 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.061 -176.164 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.55 -40.56 18.96 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.403 178.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.493 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -92.36 -45.97 7.92 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -171.105 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.529 ' HB2' HD12 ' A' 3595 ' ' LEU . 21.1 m-85 -98.47 -50.17 4.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.256 -174.438 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.785 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 21.8 mm -61.46 -58.09 9.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.738 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 98.0 m -55.57 -41.06 72.77 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 123.352 0.407 . . . . 0.0 111.456 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.749 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -68.48 -56.98 6.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.614 -0.267 . . . . 0.0 111.333 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.749 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.52 -43.55 79.89 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.526 0.203 . . . . 0.0 111.521 -177.182 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -68.07 -37.29 81.1 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.496 -177.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.25 -37.3 77.88 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.038 0.447 . . . . 0.0 110.822 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -77.35 -18.6 57.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.824 179.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 50.03 53.03 13.54 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -169.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.52 ' O ' HD12 ' A' 3603 ' ' LEU . . . -135.69 -176.02 4.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.312 -171.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.05 118.26 30.15 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.499 176.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3610 ' ' GLY . . . . . 0.424 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.93 103.78 0.84 Allowed Glycine 0 C--O 1.222 -0.605 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.485 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.686 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 31.0 mm -88.99 120.37 37.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.175 0.512 . . . . 0.0 111.055 -174.102 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.707 HD13 ' HB3' ' A' 3547 ' ' LEU . 35.0 mt -119.24 117.83 55.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.879 176.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.542 ' HA ' ' O ' ' A' 3624 ' ' TYR . 30.5 m-80 -96.73 126.04 41.62 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.348 -178.083 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.646 HG22 ' HB2' ' A' 3624 ' ' TYR . 3.4 m -119.56 158.61 48.78 Favored Pre-proline 0 C--N 1.32 -0.691 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 176.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.642 ' HA ' ' O ' ' A' 3621 ' ' GLN . 20.5 Cg_endo -61.64 140.99 89.56 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.343 2.029 . . . . 0.0 113.914 -179.23 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.567 ' HB2' ' CD2' ' A' 3624 ' ' TYR . 40.9 t30 -138.82 92.59 11.14 Favored Pre-proline 0 C--O 1.238 0.478 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.797 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -63.58 107.14 0.68 Allowed 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.945 2.43 . . . . 0.0 112.11 -178.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 137.28 -27.39 2.88 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.863 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 52.8 m -102.37 -37.3 8.11 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.155 -0.618 . . . . 0.0 112.198 -176.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -177.12 -79.41 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 177.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.686 ' HB2' ' HD3' ' A' 3622 ' ' PRO . 5.2 mp0 -154.21 -66.85 0.02 OUTLIER Pre-proline 0 C--O 1.218 -0.593 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.108 173.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.686 ' HD3' ' HB2' ' A' 3621 ' ' GLN . 85.7 Cg_endo -102.66 27.78 0.1 Allowed 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 123.638 2.892 . . . . 0.0 112.942 -175.413 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3623 ' ' ALA . . . . . 0.594 ' HB1' ' HB ' ' A' 3664 ' ' VAL . . . -70.85 49.12 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -170.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.646 ' HB2' HG22 ' A' 3614 ' ' VAL . 19.5 m-85 -133.74 133.76 42.15 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 166.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 10.7 t -117.76 114.12 44.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.555 177.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.62 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -99.36 111.19 23.6 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 169.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.547 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 40.5 mt-30 -93.85 111.76 23.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.928 -178.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.596 HG12 HG12 ' A' 3659 ' ' ILE . 42.1 mt -89.14 98.05 7.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.166 178.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -87.48 141.94 32.69 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.86 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.514 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 53.4 Cg_endo -69.3 172.96 11.27 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 122.656 2.237 . . . . 0.0 111.513 176.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.88 40.36 0.42 Allowed 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.801 2.334 . . . . 0.0 112.571 176.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 22.6 p -72.05 161.63 30.62 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.852 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -51.2 -39.58 56.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.003 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 33.9 t80 -50.76 -53.88 28.03 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.04 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 5.6 m -62.72 -56.81 14.24 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.92 -177.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.45 -41.81 69.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.881 -175.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 21.3 m -67.46 -47.89 68.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.128 -176.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 57.4 m80 -64.24 -35.77 81.9 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.271 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.22 -34.16 77.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.962 176.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.677 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 37.7 m -67.02 -29.63 69.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.76 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.59 -56.45 3.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.166 176.309 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.783 HD13 HD22 ' A' 3575 ' ' LEU . 19.2 mt -66.04 -38.5 88.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.342 -171.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.432 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -144.81 74.57 14.74 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.834 -0.166 . . . . 0.0 111.385 -178.183 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -67.76 -19.21 47.5 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.393 2.062 . . . . 0.0 111.74 -178.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3645 ' ' ASP . . . . . 0.567 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.5 m-20 -73.5 -51.58 16.6 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.004 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.722 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -77.85 -30.09 50.82 Favored 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -179.58 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.677 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -53.82 -47.34 70.97 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.33 177.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.55 -28.95 68.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.058 0.456 . . . . 0.0 111.148 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.593 ' HA ' ' HA ' ' A' 3496 ' ' VAL . 20.1 m -81.44 -33.34 32.16 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.041 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.622 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.8 pt -83.95 -10.44 11.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.235 -178.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 38.4 m -55.36 -33.61 63.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.361 176.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -84.0 -33.01 24.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.647 179.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.622 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.5 tp -105.43 38.31 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 122.41 1.1 . . . . 0.0 109.335 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.488 ' N ' ' HD2' ' A' 3655 ' ' PRO . 22.9 t -39.27 -40.84 1.39 Allowed Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 113.996 -1.456 . . . . 0.0 113.606 173.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' 3654 ' ' SER . 17.6 Cg_endo -60.21 80.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 121.647 1.565 . . . . 0.0 111.597 168.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3656 ' ' HIS . . . . . 0.414 ' HB2' HD23 ' A' 3579 ' ' LEU . 21.7 p80 -146.72 177.14 9.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.687 -177.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.462 HD22 HG22 ' A' 3628 ' ' ILE . 39.1 mt -122.41 146.93 46.9 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.278 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 61.6 ttp -109.05 107.28 17.55 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 174.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.938 HD12 HD21 ' A' 3524 ' ' LEU . 81.2 mt -99.05 116.35 41.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.295 0.569 . . . . 0.0 111.218 -172.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.656 HG13 ' HD2' ' A' 3573 ' ' TYR . 94.0 t -103.07 113.91 41.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.993 -177.179 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.622 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 62.7 mt -90.56 122.15 41.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.154 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -116.89 127.94 54.76 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.354 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 5.2 p -93.13 131.98 37.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.097 0.475 . . . . 0.0 110.868 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A 3664 ' ' VAL . . . . . 0.594 ' HB ' ' HB1' ' A' 3623 ' ' ALA . 30.6 t . . . . . 0 C--O 1.244 0.812 0 CA-C-O 118.785 -0.626 . . . . 0.0 110.021 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.603 ' CD1' ' HB2' ' A' 3553 ' ' MET . 24.5 m-85 . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 111.223 0.083 . . . . 0.0 111.223 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.502 ' CB ' ' HG2' ' A' 3552 ' ' ARG . 0.4 OUTLIER 54.96 -162.04 0.15 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.613 0.721 . . . . 0.0 111.704 177.589 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.498 ' HA ' ' HG2' ' A' 3551 ' ' GLN . 18.7 m -147.3 123.53 10.88 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 168.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.611 ' HG ' ' N ' ' B' 2522 ' ' SEP . 34.9 tp -81.39 -120.98 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.517 0 C-N-CA 119.54 -0.864 . . . . 0.0 109.956 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.653 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B 2523 ' ' ASP . . . . . 0.498 ' OD1' ' HD2' ' A' 3548 ' ' ARG . 14.7 t70 -158.07 -58.38 0.08 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.236 -1.347 . . . . 0.0 108.713 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 C--O 1.249 1.056 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.471 -177.964 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.445 HG21 ' HA ' ' A' 3649 ' ' SER . 14.3 m . . . . . 0 N--CA 1.479 1.01 0 CA-C-O 121.258 0.551 . . . . 0.0 110.786 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -106.3 144.93 32.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.929 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3498 ' ' MET . . . . . 0.634 ' HA ' ' CD2' ' A' 3501 ' ' LEU . 27.0 ptm -74.39 -19.09 60.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.195 0.521 . . . . 0.0 109.605 174.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.41 ' HA ' HD12 ' A' 3502 ' ' LEU . 47.6 t -60.32 -24.26 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.581 175.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -78.45 -59.14 2.9 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.273 175.035 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.634 ' CD2' ' HA ' ' A' 3498 ' ' MET . 2.9 pp -63.77 -35.74 81.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.455 -0.793 . . . . 0.0 113.007 -173.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.614 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.46 -15.73 62.85 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.683 -172.071 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.614 ' N ' HD13 ' A' 3502 ' ' LEU . 18.6 tptm -74.58 -16.3 60.81 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 44.3 mmtm -105.23 -43.11 5.09 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.818 173.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.729 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.68 102.48 3.45 Favored Pre-proline 0 N--CA 1.447 -0.614 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.24 -178.759 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -85.97 174.25 6.5 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 124.347 3.365 . . . . 0.0 113.602 -178.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.56 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 97.6 mt -71.98 137.18 24.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.938 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 29.6 m -104.24 -24.75 3.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.654 -178.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.634 ' CB ' HD13 ' A' 3538 ' ' LEU . 39.2 t90 -158.22 152.6 24.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.38 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3510 ' ' GLN . . . . . 0.445 ' HG3' ' HB3' ' A' 3523 ' ' GLN . 26.2 tt0 -148.2 119.94 8.08 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3511 ' ' GLY . . . . . 0.431 ' HA3' ' HA3' ' A' 3544 ' ' GLY . . . -166.54 -128.72 1.0 Allowed Glycine 0 N--CA 1.442 -0.948 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.7 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.0 mp -139.18 156.63 46.97 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.161 0.505 . . . . 0.0 111.101 178.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.491 HD23 ' HB2' ' A' 3547 ' ' LEU . 72.7 mt -109.48 151.67 26.41 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 169.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.781 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.76 124.04 13.0 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.698 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.702 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.08 142.9 38.14 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 171.91 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.702 ' HD3' HD12 ' A' 3515 ' ' LEU . 2.0 mptp? 63.79 -95.01 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -169.094 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -143.38 9.65 1.64 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.007 -0.997 . . . . 0.0 108.73 175.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.466 ' O ' ' HA ' ' A' 3514 ' ' ALA . 13.4 m-20 -94.89 128.75 41.89 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.164 -175.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.482 HG22 ' HB2' ' A' 3514 ' ' ALA . 29.0 p -118.45 134.48 55.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.059 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -129.04 116.37 19.2 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.619 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.48 119.59 14.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.933 0.397 . . . . 0.0 109.955 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' 3579 ' ' LEU . 28.0 m -128.08 147.55 32.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.664 0.745 . . . . 0.0 111.867 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3523 ' ' GLN . . . . . 0.445 ' HB3' ' HG3' ' A' 3510 ' ' GLN . 21.7 pt20 -112.29 125.17 53.88 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.599 -1.182 . . . . 0.0 108.58 173.052 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.827 HD21 HD12 ' A' 3659 ' ' ILE . 0.7 OUTLIER -96.89 112.34 24.14 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.278 0.561 . . . . 0.0 111.851 -174.773 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.56 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 73.5 m-70 -82.98 138.69 33.68 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.113 -0.948 . . . . 0.0 108.646 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.729 ' O ' ' HB2' ' A' 3505 ' ' TYR . 68.5 t80 -66.41 136.34 55.61 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 173.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.566 ' CG1' HD23 ' A' 3575 ' ' LEU . 18.9 t -115.2 -54.56 4.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 121.247 0.546 . . . . 0.0 110.931 177.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.411 ' OG ' HD22 ' A' 3642 ' ' LEU . 28.7 t -159.1 170.42 22.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.124 -169.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.11 -147.11 20.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.23 174.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' A' 3571 ' ' THR . 41.9 t30 -107.6 108.97 20.48 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -63.17 -26.66 68.91 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.706 -175.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 47.4 t -59.27 -32.31 48.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.636 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.518 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 25.2 mt -57.8 -44.6 86.44 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.009 177.133 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -65.0 -42.19 94.69 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 120.765 0.317 . . . . 0.0 110.642 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -58.34 -41.57 84.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.695 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.575 ' O ' ' HD2' ' A' 3617 ' ' PRO . 27.5 ptt180 -89.98 -4.95 57.17 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3537 ' ' SER . . . . . . . . . . . . . 13.3 p -104.43 -40.68 5.98 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.891 -0.506 . . . . 0.0 111.514 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.634 HD13 ' CB ' ' A' 3509 ' ' TRP . 22.9 mt -80.32 115.68 56.46 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-O 121.208 0.528 . . . . 0.0 110.874 -172.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3539 ' ' PRO . . . . . 0.44 ' HD3' HG21 ' A' 3614 ' ' VAL . 58.6 Cg_endo -78.26 150.96 26.13 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 123.03 2.487 . . . . 0.0 112.979 -176.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.493 ' HA ' ' CD ' ' A' 3545 ' ' PRO . 2.5 pp -151.69 170.54 19.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.95 177.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 21.5 p 175.14 -60.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.153 -176.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -96.94 -13.93 22.07 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.89 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 154.94 -61.45 0.37 Allowed Glycine 0 C--N 1.311 -0.85 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.536 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3544 ' ' GLY . . . . . 0.431 ' HA3' ' HA3' ' A' 3511 ' ' GLY . . . -164.84 88.48 0.1 Allowed Glycine 0 N--CA 1.442 -0.906 0 N-CA-C 111.68 -0.568 . . . . 0.0 111.68 174.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.493 ' CD ' ' HA ' ' A' 3540 ' ' LEU . 31.8 Cg_exo -56.99 142.36 93.9 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.573 2.182 . . . . 0.0 111.328 178.138 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.7 ' HA ' ' O ' ' A' 3512 ' ' LEU . 56.4 Cg_endo -71.53 118.14 5.5 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.284 1.989 . . . . 0.0 112.76 -172.118 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.693 ' HB3' HD13 ' A' 3612 ' ' ILE . 37.1 mt -68.3 109.69 3.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.218 174.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.781 ' HA ' ' O ' ' A' 3514 ' ' ALA . 14.9 ptt180 -96.1 139.73 31.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.358 0.599 . . . . 0.0 111.48 -173.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.47 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.8 mt -93.82 107.81 19.75 Favored 'Isoleucine or valine' 0 C--O 1.245 0.848 0 CA-C-O 122.037 0.922 . . . . 0.0 111.603 -172.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.523 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -116.85 5.37 13.0 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.363 -175.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.709 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 42.3 mt-30 -149.4 165.82 30.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.391 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.691 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -155.09 138.31 15.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 0.0 110.923 -179.783 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.555 ' HG3' ' CE2' ' B' 2518 ' ' TYR . 13.7 tmm? -111.25 121.54 45.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.5 177.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -63.01 109.88 1.62 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.631 ' O ' HD12 ' A' 3555 ' ' LEU . 3.4 pp -70.06 99.16 1.41 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 122.5 1.143 . . . . 0.0 109.703 -177.203 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' 3560 ' ' LEU . 8.4 mm-40 -104.91 152.39 22.71 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.291 178.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.576 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -53.25 -48.23 68.4 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 175.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 22.2 m -58.08 -43.84 87.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.597 176.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.551 ' O ' HG23 ' A' 3563 ' ' VAL . 12.1 mm100 -66.06 -45.7 80.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.999 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' 3556 ' ' GLU . 94.0 mt -62.88 -36.38 83.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.447 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' 3557 ' ' ALA . 8.7 mm-40 -56.19 -51.19 68.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.39 172.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -60.9 -41.73 99.4 Favored Glycine 0 CA--C 1.521 0.431 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.548 178.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' 3559 ' ' GLN . 63.1 t -62.6 -48.88 86.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.882 0.372 . . . . 0.0 110.456 177.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.78 -30.92 69.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.71 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.516 ' O ' ' HB ' ' A' 3568 ' ' THR . 34.5 ttm180 -60.53 -40.65 92.26 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.741 0.305 . . . . 0.0 111.192 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -86.6 -10.01 54.84 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.335 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' 3563 ' ' VAL . 83.1 mtp -83.25 -20.51 34.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.961 0.886 . . . . 0.0 108.969 171.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3568 ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' 3565 ' ' ARG . 23.2 m -75.5 -15.54 60.39 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 114.174 -1.376 . . . . 0.0 110.26 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 47.7 t -116.45 90.09 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.987 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.39 108.26 4.17 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.527 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 153.26 -45.48 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 O-C-N 125.057 1.473 . . . . 0.0 107.98 -174.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.08 -30.71 58.42 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.602 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.768 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -126.76 165.79 18.62 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.392 179.269 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.629 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 51.2 t -127.42 134.53 49.88 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 171.047 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.835 HD22 HD13 ' A' 3642 ' ' LEU . 15.2 tp -105.56 126.91 52.68 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.635 HD11 HD11 ' A' 3661 ' ' ILE . 76.9 mt -125.9 154.51 42.65 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.149 0.5 . . . . 0.0 110.934 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.729 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -121.55 108.33 13.48 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.074 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.526 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 123.33 37.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.365 0.602 . . . . 0.0 110.748 -177.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.419 HD23 ' HB2' ' A' 3656 ' ' HIS . 85.5 mt -123.35 143.59 41.64 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.943 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3580 ' ' PRO . . . . . 0.411 ' HA ' ' O ' ' A' 3521 ' ' ALA . 21.5 Cg_endo -61.8 110.99 1.07 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.341 2.028 . . . . 0.0 112.038 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.4 p -95.97 114.33 26.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.337 0.589 . . . . 0.0 110.532 -178.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.93 145.9 16.22 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.542 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3583 ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' 3583 ' ' ARG . 34.1 ttp180 -60.19 -47.69 84.88 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 123.728 0.811 . . . . 0.0 110.73 175.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.56 ' O ' HG23 ' A' 3588 ' ' VAL . 2.2 p30 -134.92 179.78 6.1 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.3 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -54.98 -46.65 75.12 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.246 0.341 . . . . 0.0 111.57 -175.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -67.31 -40.82 86.05 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.44 ' HB3' ' H ' ' A' 3584 ' ' ASP . 19.5 t70 -60.61 -42.53 97.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.289 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' 3584 ' ' ASP . 81.1 t -57.46 -49.26 80.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.368 176.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3589 ' ' VAL . . . . . 0.438 ' O ' ' HG2' ' A' 3593 ' ' GLU . 93.7 t -59.66 -49.37 83.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.369 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 29.7 t -59.43 -43.2 93.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.24 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -68.9 -36.09 77.62 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.841 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 88.5 m -63.01 -54.29 40.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.857 0.36 . . . . 0.0 110.78 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.9 pt-20 -62.88 -34.68 77.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.32 -178.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 50.6 m -70.22 -42.09 72.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.647 0.261 . . . . 0.0 110.721 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.594 HD12 ' HB2' ' A' 3599 ' ' PHE . 58.8 tp -63.15 -45.48 91.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.999 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.821 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 21.2 ptmt -67.51 -29.82 69.33 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.657 -0.417 . . . . 0.0 111.161 -178.023 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -80.97 -40.78 23.87 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.745 0.307 . . . . 0.0 111.656 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -90.71 -46.54 8.19 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -171.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.594 ' HB2' HD12 ' A' 3595 ' ' LEU . 9.5 m-85 -98.34 -50.01 4.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.719 0.295 . . . . 0.0 111.323 -174.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.821 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 25.6 mm -60.66 -55.03 27.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.721 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 73.3 m -56.27 -39.79 73.18 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 123.295 0.372 . . . . 0.0 110.977 179.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.79 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -66.68 -57.65 6.73 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.063 179.008 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.79 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.93 -41.25 77.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 -177.704 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -72.9 -37.1 67.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.698 -177.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.16 -33.88 72.32 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.973 0.416 . . . . 0.0 110.848 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -81.16 -19.04 44.26 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.837 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3607 ' ' GLN . . . . . 0.452 ' O ' ' HG ' ' A' 3555 ' ' LEU . 89.8 mt-30 46.31 61.32 2.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.376 0.608 . . . . 0.0 109.582 -168.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.503 ' O ' HD12 ' A' 3603 ' ' LEU . . . -137.84 -177.68 4.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.588 -173.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.691 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -118.19 117.89 30.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.212 173.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.02 101.14 0.45 Allowed Glycine 0 C--O 1.223 -0.571 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.709 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 31.4 mm -89.4 127.7 41.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 121.264 0.554 . . . . 0.0 110.977 -173.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.693 HD13 ' HB3' ' A' 3547 ' ' LEU . 71.5 mt -128.7 105.1 12.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.025 -0.989 . . . . 0.0 109.961 177.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.575 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.6 m120 -81.0 116.84 21.16 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 172.574 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.44 HG21 ' HD3' ' A' 3539 ' ' PRO . 8.0 p -120.13 135.04 24.12 Favored Pre-proline 0 C--N 1.309 -1.16 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.42 -176.229 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3615 ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.28 134.55 14.28 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.888 1.725 . . . . 0.0 111.612 174.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.538 ' HB3' ' HB2' ' A' 3619 ' ' SER . 41.6 t-20 -58.78 114.66 9.45 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.615 178.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3617 ' ' PRO . . . . . 0.575 ' HD2' ' O ' ' A' 3536 ' ' ARG . 6.0 Cg_endo -48.9 109.53 0.27 Allowed 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.2 2.6 . . . . 0.0 112.417 -178.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 102.18 -35.77 4.72 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.363 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3619 ' ' SER . . . . . 0.538 ' HB2' ' HB3' ' A' 3616 ' ' ASN . 7.6 m -96.02 -18.42 20.24 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.78 0.324 . . . . 0.0 110.967 -177.068 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 5.4 t30 64.59 16.38 10.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.275 0.63 . . . . 0.0 111.522 176.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.433 ' HA ' ' HD3' ' A' 3622 ' ' PRO . 77.4 mt-30 -81.79 108.27 10.67 Favored Pre-proline 0 C--N 1.327 -0.403 0 O-C-N 122.326 -0.234 . . . . 0.0 110.404 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' 3621 ' ' GLN . 19.7 Cg_endo -89.23 17.19 1.66 Allowed 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 123.121 2.548 . . . . 0.0 112.333 -177.209 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -81.98 41.57 0.67 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.009 -177.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.575 ' O ' ' HA ' ' A' 3613 ' ' ASN . 92.3 m-85 -127.88 132.39 49.36 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.833 178.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.424 HG13 HG23 ' A' 3611 ' ' ILE . 3.3 t -120.51 113.66 40.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.766 176.006 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.626 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.3 mp -94.98 112.25 23.97 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 171.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.458 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 36.8 mt-30 -93.99 110.71 22.38 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.299 -178.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.579 HG12 HG12 ' A' 3659 ' ' ILE . 48.0 mt -90.3 97.86 7.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.954 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -89.13 143.13 30.68 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.823 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.53 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 48.5 Cg_endo -69.12 169.26 18.5 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.305 2.004 . . . . 0.0 111.039 175.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -68.64 55.16 0.85 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.115 2.544 . . . . 0.0 112.433 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3632 ' ' CYS . . . . . 0.44 ' O ' ' HG2' ' A' 3636 ' ' GLU . 8.5 p -83.22 162.32 21.25 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.748 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.06 -42.3 76.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.355 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 19.9 t80 -60.41 -40.05 89.62 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.864 0.364 . . . . 0.0 110.272 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 12.4 t -61.33 -59.1 5.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.637 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3636 ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' 3632 ' ' CYS . 7.9 mm-40 -65.19 -34.0 77.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.297 -173.401 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 30.6 t -65.25 -48.72 72.29 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.908 0.385 . . . . 0.0 110.264 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -67.21 -32.02 72.8 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.353 178.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3639 ' ' LEU . . . . . 0.484 ' HB3' HD23 ' A' 3647 ' ' LEU . 65.0 mt -63.16 -40.32 97.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.899 175.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.63 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 38.0 m -63.83 -31.82 73.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.362 0.601 . . . . 0.0 110.153 178.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -80.11 -45.97 17.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.014 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.835 HD13 HD22 ' A' 3575 ' ' LEU . 19.5 mt -82.37 -35.0 28.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.564 -0.744 . . . . 0.0 112.449 -172.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.422 ' HB3' HG13 ' A' 3527 ' ' VAL . . . -147.86 82.57 7.83 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.86 0.362 . . . . 0.0 111.124 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.23 -26.9 48.92 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.804 2.336 . . . . 0.0 113.377 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 8.0 t70 -75.34 -52.12 11.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.096 0.474 . . . . 0.0 110.197 -173.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.729 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -71.14 -29.31 65.07 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.598 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.63 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -55.26 -52.24 64.03 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.811 0.338 . . . . 0.0 110.622 178.064 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.79 -28.61 68.88 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.042 0.449 . . . . 0.0 110.682 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.445 ' HA ' HG21 ' A' 3496 ' ' VAL . 20.3 m -76.79 -35.19 57.8 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.114 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.582 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.4 pt -83.07 -9.92 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.413 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.5 m -63.85 -16.38 61.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.214 0.53 . . . . 0.0 110.114 175.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 47.4 t30 -87.94 -38.72 15.34 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.904 173.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.582 HG22 ' HA ' ' A' 3650 ' ' ILE . 7.7 tp -105.25 41.08 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 122.527 1.156 . . . . 0.0 109.66 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.474 ' N ' ' HD2' ' A' 3655 ' ' PRO . 14.7 m -38.05 -43.06 1.52 Allowed Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 114.008 -1.451 . . . . 0.0 113.747 172.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' 3654 ' ' SER . 19.6 Cg_endo -61.27 77.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 121.631 1.554 . . . . 0.0 111.818 169.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3656 ' ' HIS . . . . . 0.419 ' HB2' HD23 ' A' 3579 ' ' LEU . 25.9 p80 -142.82 174.61 10.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.981 -177.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.486 HD22 HG22 ' A' 3628 ' ' ILE . 36.9 mt -120.63 142.05 49.79 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.301 178.119 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 13.3 tmm? -105.84 109.64 21.66 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.827 HD12 HD21 ' A' 3524 ' ' LEU . 74.6 mt -105.38 119.05 53.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.264 0.554 . . . . 0.0 111.499 -171.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.768 HG13 ' HD2' ' A' 3573 ' ' TYR . 81.0 t -102.68 116.6 46.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.686 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.635 HD11 HD11 ' A' 3576 ' ' LEU . 54.3 mt -90.53 111.86 24.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.49 128.14 56.34 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 120.97 0.414 . . . . 0.0 111.503 -177.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 8.5 m -74.06 142.11 45.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.714 171.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 84.1 t . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.418 -0.801 . . . . 0.0 109.612 175.452 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.555 ' CE2' ' HG3' ' A' 3553 ' ' MET . 1.5 m-85 . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 120.538 0.208 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.646 ' O ' ' HG2' ' A' 3551 ' ' GLN . 48.4 tt0 59.29 -175.6 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -177.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.403 ' H ' ' HG2' ' B' 2519 ' ' GLU . 6.2 p -140.59 123.83 16.71 Favored 'General case' 0 C--N 1.317 -0.831 0 O-C-N 121.795 -0.566 . . . . 0.0 110.211 178.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.677 ' HG ' ' N ' ' B' 2522 ' ' SEP . 20.7 tp -88.82 -130.37 0.08 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.245 177.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.677 ' N ' ' HG ' ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 18.3 t70 -155.84 -73.28 0.11 Allowed 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 . . . . . 0 C--O 1.247 0.969 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.522 -174.089 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.707 ' HA ' ' HA ' ' A' 3649 ' ' SER . 10.2 p . . . . . 0 N--CA 1.481 1.111 0 CA-C-O 121.789 0.804 . . . . 0.0 110.837 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3497 ' ' ASP . . . . . 0.456 ' OD2' ' HB ' ' A' 3499 ' ' VAL . 25.7 t70 -107.13 126.56 52.54 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.928 -176.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 77.8 mtp -74.49 -27.99 60.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.345 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.477 ' HA ' HD12 ' A' 3502 ' ' LEU . 27.4 t -66.92 -24.8 33.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.42 0.629 . . . . 0.0 110.447 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -72.86 -58.93 2.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.096 174.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.612 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.2 pp -69.94 -33.01 71.57 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -168.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.611 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.85 -15.46 62.64 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 120.049 -0.661 . . . . 0.0 110.023 -174.258 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.611 ' N ' HD13 ' A' 3502 ' ' LEU . 26.8 tptp -66.77 -33.53 75.83 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.882 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.409 ' HB3' ' CD2' ' A' 3505 ' ' TYR . 22.0 mttp -98.73 -43.72 6.68 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.141 0.496 . . . . 0.0 110.849 178.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.747 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -143.75 97.01 5.49 Favored Pre-proline 0 N--CA 1.441 -0.891 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.379 -176.489 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -81.85 174.17 10.51 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 124.045 3.163 . . . . 0.0 113.533 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.463 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 74.3 mt -71.33 135.79 27.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.647 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.44 HG13 ' HB2' ' A' 3526 ' ' PHE . 32.8 m -109.04 -24.39 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.927 -176.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.716 ' HE3' HD12 ' A' 3524 ' ' LEU . 34.6 t90 -151.3 153.72 35.37 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.673 0.273 . . . . 0.0 110.362 -176.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -150.92 119.76 6.61 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -176.32 -134.02 1.88 Allowed Glycine 0 N--CA 1.445 -0.751 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -136.32 154.45 50.86 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.194 0.521 . . . . 0.0 111.334 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.483 HD23 ' HB2' ' A' 3547 ' ' LEU . 78.1 mt -107.45 152.76 23.78 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 170.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.696 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -148.29 123.64 10.29 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -177.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.614 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.81 143.46 38.91 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 173.117 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.614 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.4 OUTLIER 62.87 -94.97 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 -169.294 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -142.91 10.44 1.77 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 173.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.509 ' O ' ' HA ' ' A' 3514 ' ' ALA . 62.2 m-20 -91.88 128.31 37.68 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.55 -174.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.406 HG22 ' HB2' ' A' 3514 ' ' ALA . 11.9 p -119.13 137.74 53.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.337 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -137.26 118.69 14.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.458 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.626 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.96 124.84 26.25 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 177.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 29.5 m -134.4 147.61 29.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.609 0.718 . . . . 0.0 111.862 -175.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3523 ' ' GLN . . . . . 0.54 ' HG2' ' HB3' ' A' 3581 ' ' CYS . 9.1 pt20 -111.47 125.61 54.08 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.023 -0.99 . . . . 0.0 108.709 171.291 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.83 HD21 HD12 ' A' 3659 ' ' ILE . 2.2 mt -93.29 111.68 23.39 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.86 -175.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.463 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 68.2 m-70 -85.05 138.01 32.7 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.209 -0.905 . . . . 0.0 108.897 174.014 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.747 ' O ' ' HB2' ' A' 3505 ' ' TYR . 66.0 t80 -67.59 141.15 56.89 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 173.252 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.587 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.9 t -115.7 -54.91 4.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 121.387 0.613 . . . . 0.0 110.764 174.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.47 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 68.5 m -160.69 172.01 17.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.786 -171.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3529 ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' 3570 ' ' GLU . . . 89.33 -151.11 21.75 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.298 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.565 ' HB2' ' HA ' ' A' 3571 ' ' THR . 39.7 t30 -108.26 117.6 34.58 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.597 0.237 . . . . 0.0 110.5 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.2 p30 -62.69 -29.14 70.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.4 -176.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3532 ' ' VAL . . . . . 0.434 ' HB ' HD21 ' A' 3530 ' ' ASN . 60.2 t -57.93 -34.75 49.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.37 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.423 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 34.2 mt -59.11 -46.22 88.88 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.466 ' HB1' HD12 ' A' 3538 ' ' LEU . . . -66.36 -41.34 89.63 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 120.84 0.352 . . . . 0.0 110.474 -177.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -60.43 -39.18 86.51 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.356 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -89.01 -17.74 28.78 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.487 ' HB2' HD11 ' A' 3626 ' ' LEU . 51.0 p -93.28 -41.61 9.78 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.966 -0.459 . . . . 0.0 110.788 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.684 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.4 mt -80.56 110.39 16.78 Favored Pre-proline 0 C--N 1.32 -0.677 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 -179.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.83 139.23 15.42 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.554 2.169 . . . . 0.0 112.369 -176.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.488 ' CD1' ' HA3' ' A' 3544 ' ' GLY . 29.2 mt 48.17 -154.17 0.08 Allowed 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.742 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 67.3 m -159.76 -39.68 0.05 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.509 -1.223 . . . . 0.0 109.017 165.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -130.4 154.42 47.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.455 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 66.32 37.17 92.6 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.228 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3544 ' ' GLY . . . . . 0.488 ' HA3' ' CD1' ' A' 3540 ' ' LEU . . . -157.63 -178.03 31.3 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.68 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.468 ' HA ' ' HD3' ' A' 3546 ' ' PRO . 72.1 Cg_endo -76.38 139.99 21.37 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.939 2.426 . . . . 0.0 113.011 -178.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 21.5 Cg_exo -67.36 158.31 57.63 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.909 2.406 . . . . 0.0 111.616 173.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.678 ' HB3' HD13 ' A' 3612 ' ' ILE . 19.7 mt -69.04 109.23 3.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.263 177.52 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.696 ' HA ' ' O ' ' A' 3514 ' ' ALA . 18.5 ptt180 -90.98 144.49 25.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.81 0.338 . . . . 0.0 110.902 -178.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.435 HG22 HD22 ' B' 2521 ' ' LEU . 19.6 mt -99.19 110.93 27.48 Favored 'Isoleucine or valine' 0 C--O 1.246 0.874 0 CA-C-O 121.848 0.832 . . . . 0.0 111.12 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.617 ' CB ' ' HA ' ' B' 2525 ' ' GLU . . . -117.42 5.92 12.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.281 -174.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.669 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 58.9 mt-30 -152.89 170.26 20.79 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.386 0.136 . . . . 0.0 110.935 177.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.714 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -153.18 139.29 18.3 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.744 0.307 . . . . 0.0 111.528 -177.609 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.609 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.7 tmm? -116.88 111.65 19.96 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.839 176.082 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 75.9 mtm-85 -61.07 111.03 1.53 Allowed 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.425 ' O ' HD12 ' A' 3555 ' ' LEU . 1.8 pp -68.53 98.34 0.86 Allowed 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.071 0.939 . . . . 0.0 109.545 -176.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.607 ' O ' ' HG ' ' A' 3560 ' ' LEU . 13.0 mm-40 -109.62 164.35 12.61 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.643 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -53.34 -51.39 62.57 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.884 0.373 . . . . 0.0 111.447 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 21.0 p -65.42 -36.56 84.29 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.982 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.499 ' O ' HG23 ' A' 3563 ' ' VAL . 16.0 mm100 -64.91 -37.83 88.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.753 178.093 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' 3556 ' ' GLU . 86.4 mt -64.85 -31.33 72.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.648 179.259 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -67.12 -44.25 80.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.206 0.527 . . . . 0.0 110.098 173.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -56.16 -45.46 87.72 Favored Glycine 0 CA--C 1.518 0.225 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.819 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.576 ' O ' ' HG2' ' A' 3566 ' ' ARG . 60.0 t -62.55 -43.63 98.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 0.0 110.342 176.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -56.8 -39.87 74.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.26 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.61 ' O ' ' HB ' ' A' 3568 ' ' THR . 45.8 ttt180 -58.33 -44.11 88.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.678 0.275 . . . . 0.0 111.469 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3566 ' ' ARG . . . . . 0.576 ' HG2' ' O ' ' A' 3563 ' ' VAL . 5.7 ptp180 -76.69 -20.07 57.0 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.49 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.572 ' HG2' ' CE2' ' A' 3573 ' ' TYR . 81.3 mtp -84.61 -11.74 55.37 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.319 0.581 . . . . 0.0 109.964 175.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3568 ' ' THR . . . . . 0.61 ' HB ' ' O ' ' A' 3565 ' ' ARG . 3.3 m -74.8 -23.93 58.57 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.171 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 60.6 t -126.58 101.27 7.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.257 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3570 ' ' GLU . . . . . 0.438 ' HB3' ' HA2' ' A' 3529 ' ' GLY . 44.9 mt-10 -75.72 109.0 8.95 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.565 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.2 m 148.55 -38.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.646 1.578 . . . . 0.0 107.287 -172.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.85 -27.53 40.12 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.238 176.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.746 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -131.36 164.0 26.63 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.064 176.237 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.641 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 47.7 t -127.74 135.43 50.13 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 171.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.731 HD22 HD13 ' A' 3642 ' ' LEU . 13.6 tp -104.67 125.66 51.0 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.578 HD11 HD11 ' A' 3661 ' ' ILE . 64.5 mt -126.18 158.2 36.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.245 0.545 . . . . 0.0 111.217 -176.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.54 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -126.13 107.93 10.86 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.699 178.79 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.508 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.83 123.04 38.06 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.251 0.548 . . . . 0.0 110.626 -177.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.438 HD21 HG22 ' A' 3650 ' ' ILE . 83.4 mt -123.02 142.56 38.48 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.299 -179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3580 ' ' PRO . . . . . 0.412 ' HA ' ' O ' ' A' 3521 ' ' ALA . 19.7 Cg_endo -61.87 112.11 1.4 Allowed 'Trans proline' 0 C--O 1.234 0.312 0 C-N-CA 122.382 2.055 . . . . 0.0 111.835 178.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3581 ' ' CYS . . . . . 0.54 ' HB3' ' HG2' ' A' 3523 ' ' GLN . 28.9 p -98.7 120.25 38.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.005 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3582 ' ' GLY . . . . . 0.469 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -97.52 142.69 16.29 Favored Glycine 0 N--CA 1.439 -1.111 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.536 -178.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 45.2 mtt85 -66.32 -31.42 72.2 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.037 0.922 . . . . 0.0 109.041 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.577 ' O ' HG23 ' A' 3588 ' ' VAL . 28.7 t70 -144.93 170.04 16.91 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.062 -1.426 . . . . 0.0 107.739 176.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -56.5 -38.11 71.31 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 118.203 0.456 . . . . 0.0 110.347 177.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -61.05 -46.72 89.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.383 0.611 . . . . 0.0 109.765 176.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.598 ' O ' ' HG2' ' A' 3591 ' ' GLN . 6.2 t70 -60.5 -44.75 95.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.173 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' 3584 ' ' ASP . 86.9 t -52.18 -41.37 33.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.104 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3589 ' ' VAL . . . . . 0.447 ' O ' ' HG2' ' A' 3593 ' ' GLU . 3.6 t -63.82 -52.32 58.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.685 0.755 . . . . 0.0 109.399 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 71.6 m -58.22 -43.83 87.91 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.116 -1.402 . . . . 0.0 111.977 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3591 ' ' GLN . . . . . 0.598 ' HG2' ' O ' ' A' 3587 ' ' ASP . 18.1 mm-40 -68.61 -41.31 79.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.038 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 83.2 m -61.45 -52.42 64.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.095 -178.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.1 pt-20 -67.23 -32.75 74.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.288 -178.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 28.1 t -64.78 -46.38 82.35 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 176.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.557 HD12 ' HB2' ' A' 3599 ' ' PHE . 52.0 tp -63.76 -46.2 86.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.231 -178.303 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.79 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.7 -29.26 69.78 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.493 -175.973 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 3597 ' ' ALA . . . . . 0.457 ' O ' ' HB ' ' A' 3601 ' ' THR . . . -85.91 -42.38 14.13 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.908 0.385 . . . . 0.0 111.256 179.132 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.426 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -85.24 -45.85 11.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -170.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.557 ' HB2' HD12 ' A' 3595 ' ' LEU . 15.1 m-85 -99.34 -50.41 4.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.704 0.288 . . . . 0.0 111.18 -176.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.79 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 26.3 mm -61.38 -55.78 22.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.066 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3601 ' ' THR . . . . . 0.457 ' HB ' ' O ' ' A' 3597 ' ' ALA . 74.4 m -60.43 -38.27 83.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.687 0.28 . . . . 0.0 111.221 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.775 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -67.05 -55.84 12.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.687 178.336 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.775 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.82 -41.98 78.8 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -178.354 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -70.74 -37.81 73.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.594 -177.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.13 -38.53 82.3 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 121.085 0.469 . . . . 0.0 110.626 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3606 ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' 3602 ' ' TYR . 69.6 mmtt -77.5 -19.43 55.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.482 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 87.4 mt-30 49.9 49.94 19.34 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.625 -169.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.523 ' O ' HD12 ' A' 3603 ' ' LEU . . . -128.5 -175.48 3.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.362 0.601 . . . . 0.0 112.169 -171.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.714 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.67 117.82 29.28 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.239 175.307 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.02 102.55 0.59 Allowed Glycine 0 C--O 1.221 -0.666 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 176.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.669 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.3 mm -89.21 121.4 39.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 121.204 0.526 . . . . 0.0 110.84 -174.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.678 HD13 ' HB3' ' A' 3547 ' ' LEU . 57.6 mt -117.87 105.38 17.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.444 175.139 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 18.3 m120 -87.41 115.32 24.74 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.867 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 3.3 p -119.63 126.98 26.67 Favored Pre-proline 0 C--N 1.314 -0.939 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.583 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.499 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 47.4 Cg_endo -70.35 138.73 36.6 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.296 1.997 . . . . 0.0 111.95 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.699 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 53.1 t30 -63.08 116.34 24.07 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.407 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3617 ' ' PRO . . . . . 0.451 ' HD2' ' HA ' ' A' 3616 ' ' ASN . 10.5 Cg_endo -54.01 108.86 0.31 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.152 2.568 . . . . 0.0 112.33 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 115.09 -32.25 5.87 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.1 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 15.6 m -106.6 -22.21 12.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.754 0.311 . . . . 0.0 110.907 -179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 12.2 t-20 66.76 11.61 8.34 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.336 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3621 ' ' GLN . . . . . . . . . . . . . 87.5 mm-40 -80.62 116.8 64.53 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.499 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 88.0 Cg_endo -77.3 25.87 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 123.598 2.865 . . . . 0.0 113.033 -176.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -73.87 27.4 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -174.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.699 ' HE2' ' HB2' ' A' 3616 ' ' ASN . 85.5 m-85 -123.15 132.16 53.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.134 0.492 . . . . 0.0 110.58 178.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 4.2 t -124.84 117.27 49.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.003 178.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.631 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -98.17 112.25 24.29 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 170.264 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.485 ' HB3' ' HB1' ' A' 3609 ' ' ALA . 34.0 mt-30 -94.72 110.47 22.31 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.658 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.588 HG12 HG12 ' A' 3659 ' ' ILE . 38.7 mt -92.14 98.06 7.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.027 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3629 ' ' PHE . . . . . 0.63 ' HB2' ' HE3' ' A' 3658 ' ' MET . 97.5 m-85 -89.78 147.67 38.11 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.764 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.449 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.8 Cg_endo -70.35 171.02 15.91 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.364 2.043 . . . . 0.0 111.134 175.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.37 42.04 0.45 Allowed 'Trans proline' 0 CA--C 1.532 0.425 0 C-N-CA 123.025 2.483 . . . . 0.0 112.603 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 24.8 p -72.56 163.36 28.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.151 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -44.95 -47.97 11.37 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 123.721 0.638 . . . . 0.0 110.937 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 26.6 t80 -48.95 -55.43 11.88 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.653 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3635 ' ' SER . . . . . 0.49 ' HA ' ' HE2' ' A' 3658 ' ' MET . 19.7 m -56.58 -58.09 9.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.979 -177.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -60.81 -35.43 76.49 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.388 -174.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 66.4 m -57.34 -61.99 2.09 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.072 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -69.83 -20.36 63.44 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.143 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 62.8 mt -66.03 -35.97 81.99 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.364 174.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.803 ' HA ' HD22 ' A' 3647 ' ' LEU . 15.3 m -69.6 -35.31 75.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.321 0.581 . . . . 0.0 110.467 178.502 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -81.14 -37.79 28.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.058 -178.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.731 HD13 HD22 ' A' 3575 ' ' LEU . 15.7 mt -89.37 -31.11 17.93 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -174.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.433 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -153.0 72.53 7.11 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -176.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3644 ' ' PRO . . . . . 0.627 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 50.3 Cg_endo -70.87 -17.17 32.73 Favored 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 122.152 1.901 . . . . 0.0 111.856 177.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3645 ' ' ASP . . . . . 0.518 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 40.1 m-20 -72.73 -45.0 60.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.177 -177.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.612 ' HB2' HD13 ' A' 3501 ' ' LEU . 0.1 OUTLIER -83.09 -28.79 29.24 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 176.634 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.803 HD22 ' HA ' ' A' 3640 ' ' SER . 22.4 tp -50.54 -47.05 57.8 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.546 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.15 -19.01 61.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.945 0.402 . . . . 0.0 111.705 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.707 ' HA ' ' HA ' ' A' 3496 ' ' VAL . 36.6 m -89.69 -31.05 17.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.839 0.352 . . . . 0.0 110.824 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.546 ' HA ' HG22 ' A' 3653 ' ' ILE . 6.5 pt -85.83 -13.77 10.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.623 -178.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 47.4 m -59.48 -22.17 61.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.795 0.331 . . . . 0.0 111.222 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -88.02 -38.37 15.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.481 0.658 . . . . 0.0 109.758 174.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.568 HD12 ' HG2' ' A' 3655 ' ' PRO . 8.2 tp -105.26 42.4 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 122.288 1.042 . . . . 0.0 109.408 -178.16 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.486 ' N ' ' HD2' ' A' 3655 ' ' PRO . 42.0 m -40.37 -42.0 2.86 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 114.384 -1.28 . . . . 0.0 113.148 171.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.568 ' HG2' HD12 ' A' 3653 ' ' ILE . 11.2 Cg_endo -58.15 83.45 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.635 1.557 . . . . 0.0 111.404 167.192 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.0 p-80 -149.26 169.71 20.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.253 -177.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.52 HD22 HG22 ' A' 3628 ' ' ILE . 46.3 mt -117.57 132.83 56.46 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.581 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3658 ' ' MET . . . . . 0.63 ' HE3' ' HB2' ' A' 3629 ' ' PHE . 9.5 tmm? -99.61 109.82 22.3 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 177.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.83 HD12 HD21 ' A' 3524 ' ' LEU . 74.2 mt -107.31 121.48 60.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 121.281 0.562 . . . . 0.0 111.566 -170.152 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.746 HG13 ' HD2' ' A' 3573 ' ' TYR . 91.8 t -104.56 113.8 42.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.727 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.641 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 58.3 mt -91.02 115.53 30.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.829 177.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -124.47 132.51 53.49 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.834 -0.346 . . . . 0.0 111.622 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 24.7 m -86.03 112.44 21.24 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 171.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.533 -178.65 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.609 ' CD1' ' HB2' ' A' 3553 ' ' MET . 57.0 m-85 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.565 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.6 OUTLIER 56.13 -162.02 0.18 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.829 0.823 . . . . 0.0 111.848 176.69 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 25.7 m -146.32 117.88 8.02 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 114.613 -1.176 . . . . 0.0 108.032 168.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.59 ' HG ' ' N ' ' B' 2522 ' ' SEP . 24.4 tp -80.04 -130.15 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.042 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.59 ' N ' ' HG ' ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 12.4 t70 -177.77 -74.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.027 -1.442 . . . . 0.0 107.64 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2524 ' ' SEP . . . . . 0.455 ' O ' ' HB2' ' B' 2525 ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B 2525 ' ' GLU . . . . . 0.617 ' HA ' ' CB ' ' A' 3550 ' ' ALA . 29.9 tt0 . . . . . 0 C--O 1.245 0.821 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.197 174.265 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.402 ' CG1' ' HA ' ' A' 3649 ' ' SER . 21.8 m . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 121.073 0.463 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -102.56 115.18 30.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.988 -175.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 4.2 mpp? -75.1 -10.9 59.9 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.306 0.574 . . . . 0.0 109.817 178.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 25.9 t -61.66 -21.56 25.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.889 176.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -83.3 -58.97 2.61 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.848 0.356 . . . . 0.0 110.898 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.587 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp -60.27 -32.29 71.03 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -172.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.592 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.37 -15.56 63.75 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.546 -174.065 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.592 ' N ' HD13 ' A' 3502 ' ' LEU . 13.7 mptt -57.41 -42.64 82.69 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.212 173.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.477 ' HB3' ' CD2' ' A' 3505 ' ' TYR . 5.1 tmtm? -95.45 -38.6 10.39 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.315 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.737 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -147.06 101.39 3.87 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-O 121.302 0.572 . . . . 0.0 111.629 -177.422 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -86.23 174.02 6.38 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 124.158 3.239 . . . . 0.0 113.723 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.48 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 88.2 mt -71.88 131.34 34.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.243 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 29.3 m -100.96 -28.82 3.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.466 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.671 ' HE3' HD12 ' A' 3524 ' ' LEU . 14.0 t90 -153.11 155.05 36.05 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 110.229 -0.285 . . . . 0.0 110.229 -175.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -150.95 119.93 6.67 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.74 -130.52 1.23 Allowed Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 -178.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -136.87 152.71 50.54 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.359 0.6 . . . . 0.0 111.437 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.48 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 72.6 mt -105.53 153.61 21.51 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 168.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.666 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -146.64 124.07 11.67 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -177.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.785 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.3 144.61 38.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.687 172.674 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.785 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.7 OUTLIER 59.36 -93.56 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 122.964 0.506 . . . . 0.0 110.293 -170.898 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 20.2 m120 -141.78 7.31 1.86 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.842 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -104.51 129.67 52.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.115 0.484 . . . . 0.0 111.205 -177.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.613 HG22 ' HB2' ' A' 3514 ' ' ALA . 18.0 p -108.96 154.81 21.64 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.509 176.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -143.97 113.49 7.03 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.776 175.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.636 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.52 115.87 10.2 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.115 0.483 . . . . 0.0 110.059 177.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 28.0 m -129.67 147.77 33.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.582 0.706 . . . . 0.0 111.795 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3523 ' ' GLN . . . . . 0.428 ' HG2' ' HB3' ' A' 3581 ' ' CYS . 3.8 pt20 -108.59 125.73 52.16 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.021 -0.99 . . . . 0.0 108.861 172.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.879 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -93.07 111.37 22.98 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.421 0.629 . . . . 0.0 111.716 -175.957 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.48 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 70.2 m-70 -87.65 136.56 32.9 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.878 -1.055 . . . . 0.0 108.595 175.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.737 ' O ' ' HB2' ' A' 3505 ' ' TYR . 63.9 t80 -64.77 141.09 58.89 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.589 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.1 t -115.3 -58.36 3.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 CA-C-O 121.386 0.612 . . . . 0.0 110.64 174.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.502 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 58.3 m -160.74 171.66 18.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.197 -171.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.59 -149.0 20.29 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.516 -0.849 . . . . 0.0 112.609 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.563 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.0 t-20 -101.6 111.54 23.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.599 0.237 . . . . 0.0 110.494 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -61.15 -31.7 71.42 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.589 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 23.6 t -63.16 -32.3 55.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.508 -178.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.565 HD23 ' HD3' ' A' 3536 ' ' ARG . 28.8 mt -57.59 -39.44 76.81 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.086 177.474 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.473 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -67.38 -46.85 72.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.921 0.391 . . . . 0.0 110.297 179.288 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -63.58 -27.66 69.4 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.286 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.565 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.8 ptm180 -90.32 -14.92 32.18 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.452 ' O ' HG21 ' A' 3614 ' ' VAL . 21.7 p -103.78 -38.23 7.14 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.854 0.359 . . . . 0.0 111.949 -179.322 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.635 HD13 ' HB2' ' A' 3509 ' ' TRP . 19.4 mt -79.98 121.04 81.63 Favored Pre-proline 0 C--N 1.317 -0.815 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -175.063 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3539 ' ' PRO . . . . . 0.613 ' HB2' ' HG2' ' A' 3545 ' ' PRO . 6.6 Cg_endo -74.74 126.97 10.49 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.592 2.194 . . . . 0.0 113.667 -173.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 1.2 pt? -146.41 -163.92 1.86 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.402 177.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 40.3 m 78.51 -22.67 0.27 Allowed 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.578 0.751 . . . . 0.0 111.899 174.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -139.56 91.83 2.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.29 0.566 . . . . 0.0 111.217 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 70.66 -67.07 0.79 Allowed Glycine 0 CA--C 1.517 0.214 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.852 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 120.63 71.88 0.32 Allowed Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.831 -0.508 . . . . 0.0 111.831 -178.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.613 ' HG2' ' HB2' ' A' 3539 ' ' PRO . 27.9 Cg_endo -63.76 127.48 19.74 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.421 2.081 . . . . 0.0 111.711 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 16.4 Cg_exo -66.42 145.52 77.41 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.608 2.206 . . . . 0.0 112.018 -178.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.666 ' HB3' HD13 ' A' 3612 ' ' ILE . 56.6 mt -74.09 112.25 10.04 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.932 177.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.666 ' HA ' ' O ' ' A' 3514 ' ' ALA . 16.2 ptt-85 -103.16 142.52 34.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.149 0.499 . . . . 0.0 111.003 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.483 HG22 HD12 ' B' 2521 ' ' LEU . 33.2 mt -95.86 108.76 21.58 Favored 'Isoleucine or valine' 0 C--O 1.245 0.855 0 CA-C-O 121.878 0.847 . . . . 0.0 112.016 -171.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.496 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.3 -1.28 15.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.966 -176.082 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.673 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 41.6 mt-30 -149.95 170.66 18.31 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.423 0.154 . . . . 0.0 111.038 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.719 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.14 141.21 17.34 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.934 0.397 . . . . 0.0 111.193 -179.68 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.601 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -110.6 121.39 45.2 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.402 178.239 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -63.34 110.68 1.99 Allowed 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.612 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -70.16 99.54 1.51 Allowed 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 122.152 0.977 . . . . 0.0 109.791 -178.103 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.597 ' O ' ' HG ' ' A' 3560 ' ' LEU . 38.5 mt-10 -112.91 160.08 18.42 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.634 -1.166 . . . . 0.0 109.659 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.607 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -52.53 -52.36 55.12 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.414 0.446 . . . . 0.0 111.202 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 7.0 p -58.85 -42.38 89.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.42 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.547 ' O ' HG23 ' A' 3563 ' ' VAL . 13.9 mm100 -62.1 -48.07 81.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.035 177.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' 3556 ' ' GLU . 87.0 mt -61.05 -34.46 74.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.404 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' A' 3557 ' ' ALA . 29.6 mm-40 -59.38 -51.89 67.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.174 0.511 . . . . 0.0 109.878 175.635 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.31 -38.89 96.44 Favored Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.312 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' 3559 ' ' GLN . 83.9 t -61.24 -56.39 18.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.535 0.207 . . . . 0.0 110.644 178.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3564 ' ' ALA . . . . . 0.404 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -65.23 -29.03 69.79 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -175.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.416 ' NH1' ' HB3' ' A' 3561 ' ' GLU . 72.2 mtt180 -75.9 -22.83 55.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3566 ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' 3563 ' ' VAL . 36.4 ptt180 -89.49 -12.32 40.4 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.669 169.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.536 ' HG3' ' O ' ' A' 3563 ' ' VAL . 78.1 mtp -81.72 -19.06 42.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.785 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 21.8 p -75.09 -19.23 60.06 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.408 0.623 . . . . 0.0 110.081 176.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.7 t -95.93 79.52 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.002 177.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.65 108.41 2.89 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.563 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 153.44 -43.24 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.52 1.528 . . . . 0.0 108.053 -175.179 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.25 -30.65 34.05 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.832 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.718 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -125.69 165.31 18.83 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.172 -179.891 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.625 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 25.4 t -127.09 135.79 51.25 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 171.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.762 HD22 HD13 ' A' 3642 ' ' LEU . 13.9 tp -106.16 125.17 50.66 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 178.736 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.61 HD11 HD11 ' A' 3661 ' ' ILE . 79.1 mt -127.19 151.78 48.24 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.149 0.499 . . . . 0.0 110.755 -177.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.698 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.03 108.68 14.59 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.512 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.39 122.4 36.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.304 0.573 . . . . 0.0 110.431 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.621 HD21 HG22 ' A' 3650 ' ' ILE . 82.5 mt -122.13 140.83 33.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.184 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.88 112.72 1.44 Allowed 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.393 2.062 . . . . 0.0 111.819 178.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3581 ' ' CYS . . . . . 0.428 ' HB3' ' HG2' ' A' 3523 ' ' GLN . 25.7 p -99.75 118.47 36.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.116 0.484 . . . . 0.0 110.293 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3582 ' ' GLY . . . . . 0.429 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.33 145.57 16.26 Favored Glycine 0 N--CA 1.442 -0.948 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.652 -178.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -76.87 -31.23 56.66 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.907 0.86 . . . . 0.0 109.353 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.562 ' H ' ' HB3' ' A' 3587 ' ' ASP . 22.8 t70 -134.47 167.66 20.36 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.346 -178.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -54.6 -43.55 72.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.005 0.431 . . . . 0.0 110.348 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.32 -33.68 71.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.176 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.562 ' HB3' ' H ' ' A' 3584 ' ' ASP . 6.8 t70 -64.93 -42.77 94.39 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' 3584 ' ' ASP . 93.8 t -56.28 -50.96 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.202 176.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 75.1 t -58.21 -50.51 78.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.695 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 42.1 t -55.43 -51.12 67.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.319 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -65.73 -36.98 85.13 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 121.22 -0.192 . . . . 0.0 111.225 -177.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3592 ' ' THR . . . . . 0.446 ' O ' ' HB3' ' A' 3596 ' ' LYS . 49.2 m -64.41 -44.71 90.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.957 0.408 . . . . 0.0 110.181 176.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.453 ' HA ' ' CE ' ' A' 3596 ' ' LYS . 12.9 tp10 -61.01 -47.16 87.73 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.604 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 39.4 m -65.85 -47.72 73.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.047 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.554 HD12 ' HB2' ' A' 3599 ' ' PHE . 59.6 tp -59.5 -44.15 93.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.87 0.367 . . . . 0.0 110.73 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.695 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.9 OUTLIER -62.59 -35.76 80.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.262 -178.033 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3597 ' ' ALA . . . . . 0.417 ' O ' ' HB ' ' A' 3601 ' ' THR . . . -83.59 -41.18 18.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.728 0.299 . . . . 0.0 111.725 -178.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.494 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -86.57 -46.27 10.29 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -170.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.554 ' HB2' HD12 ' A' 3595 ' ' LEU . 19.6 m-85 -99.45 -50.5 4.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.711 0.291 . . . . 0.0 111.166 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.695 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.2 mm -60.88 -57.01 14.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.664 -176.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3601 ' ' THR . . . . . 0.417 ' HB ' ' O ' ' A' 3597 ' ' ALA . 91.7 m -56.29 -49.11 75.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.022 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.663 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -59.52 -57.33 13.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.158 -179.489 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.663 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.3 OUTLIER -55.83 -42.28 75.49 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -178.52 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -75.85 -40.03 55.49 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.848 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -66.1 -46.43 77.64 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.988 0.423 . . . . 0.0 110.97 -178.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -77.74 -11.59 59.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.281 -178.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 50.36 63.22 2.29 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.255 -174.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.558 ' O ' HD12 ' A' 3603 ' ' LEU . . . -138.35 -176.28 4.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.213 0.53 . . . . 0.0 112.317 -173.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.719 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -122.89 117.78 26.37 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.33 174.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3610 ' ' GLY . . . . . 0.449 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.36 103.7 0.78 Allowed Glycine 0 C--O 1.222 -0.621 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.499 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.673 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 28.8 mm -89.42 124.33 42.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 121.212 0.53 . . . . 0.0 110.659 -175.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.666 HD13 ' HB3' ' A' 3547 ' ' LEU . 62.1 mt -124.2 105.99 16.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.108 177.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' 3624 ' ' TYR . 7.1 m120 -80.77 112.31 18.03 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.452 HG21 ' O ' ' A' 3537 ' ' SER . 6.2 p -113.58 127.58 26.66 Favored Pre-proline 0 C--N 1.311 -1.068 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.815 -177.368 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.574 ' HB2' ' HA ' ' A' 3620 ' ' ASN . 79.2 Cg_endo -83.12 136.8 8.1 Favored 'Trans proline' 0 N--CA 1.448 -1.193 0 C-N-CA 122.38 2.053 . . . . 0.0 111.808 173.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.421 ' HA ' ' HD3' ' A' 3617 ' ' PRO . 8.5 p30 -62.72 115.88 19.91 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.028 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3617 ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' 3616 ' ' ASN . 77.8 Cg_exo -49.94 123.87 11.57 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.367 2.711 . . . . 0.0 112.821 -174.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 109.42 -50.99 0.73 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.003 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 1.7 p -97.27 -25.81 15.13 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.822 0.344 . . . . 0.0 110.99 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3620 ' ' ASN . . . . . 0.574 ' HA ' ' HB2' ' A' 3615 ' ' PRO . 21.4 t-20 59.75 72.61 0.52 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.579 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.573 ' O ' ' HA ' ' A' 3615 ' ' PRO . 94.5 mt-30 -127.0 109.27 21.86 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.126 171.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3622 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.63 24.5 0.46 Allowed 'Trans proline' 0 C--O 1.234 0.321 0 C-N-CA 123.413 2.742 . . . . 0.0 113.606 -173.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -75.99 47.47 0.44 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.87 0.367 . . . . 0.0 111.914 -178.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.51 ' O ' ' HA ' ' A' 3613 ' ' ASN . 78.7 m-85 -141.34 133.53 27.93 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.373 176.273 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 20.1 t -116.1 114.98 47.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.935 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.599 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -99.45 115.44 29.28 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 168.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.501 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 97.9 mt-30 -94.66 111.32 23.09 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.04 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.594 HG12 HG12 ' A' 3659 ' ' ILE . 43.9 mt -90.46 98.46 8.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.961 178.096 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -88.48 145.04 34.66 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.085 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.558 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.3 Cg_endo -69.91 172.84 12.04 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.744 2.296 . . . . 0.0 111.901 177.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -70.88 46.69 0.66 Allowed 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 122.97 2.447 . . . . 0.0 112.272 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.5 p -80.66 162.63 24.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.276 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3633 ' ' GLU . . . . . 0.41 ' H ' ' CD ' ' A' 3633 ' ' GLU . 3.3 mp0 -53.73 -38.96 64.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.012 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 32.0 t80 -49.69 -50.04 45.26 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 121.284 0.564 . . . . 0.0 110.95 174.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 4.1 m -64.95 -52.9 53.77 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.153 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -52.19 -50.65 61.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.143 -176.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 51.3 p -60.56 -50.45 73.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.174 0.512 . . . . 0.0 110.711 -175.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 72.1 m80 -66.3 -36.24 82.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.975 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 76.4 mt -64.29 -34.67 78.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.052 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.989 ' HA ' HD22 ' A' 3647 ' ' LEU . 34.8 m -64.12 -37.1 86.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.224 0.535 . . . . 0.0 110.412 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.82 -51.11 9.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.202 178.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.762 HD13 HD22 ' A' 3575 ' ' LEU . 30.1 mt -72.45 -34.39 67.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.789 -171.342 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.422 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -151.35 84.39 5.22 Favored Pre-proline 0 C--N 1.328 -0.334 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -73.52 -23.12 17.56 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.6 2.2 . . . . 0.0 113.372 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 12.3 t0 -76.46 -52.91 8.91 Favored 'General case' 0 CA--C 1.515 -0.365 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 -175.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.698 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -69.79 -28.32 65.64 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 178.625 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.989 HD22 ' HA ' ' A' 3640 ' ' SER . 31.7 tp -51.12 -50.13 59.45 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.914 174.482 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.33 -23.75 65.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.179 -178.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.402 ' HA ' ' CG1' ' A' 3496 ' ' VAL . 12.9 m -83.43 -36.38 24.26 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.436 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.621 HG22 HD21 ' A' 3579 ' ' LEU . 4.3 pt -81.31 -17.28 12.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.487 -177.09 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 49.6 m -58.44 -22.55 54.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.91 175.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -89.28 -37.09 15.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.016 0.436 . . . . 0.0 110.787 174.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.582 HG22 ' HA ' ' A' 3650 ' ' ILE . 7.5 tp -104.51 39.76 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 122.473 1.13 . . . . 0.0 109.307 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.464 ' N ' ' HD2' ' A' 3655 ' ' PRO . 20.2 m -35.53 -44.57 0.84 Allowed Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 113.784 -1.553 . . . . 0.0 114.038 173.156 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' 3654 ' ' SER . 20.2 Cg_endo -62.46 76.12 0.1 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.541 1.494 . . . . 0.0 112.008 171.199 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 34.6 p80 -145.65 175.47 10.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.121 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.478 HD22 HG22 ' A' 3628 ' ' ILE . 21.6 mt -120.6 152.32 38.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.77 -177.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 57.4 ttp -112.0 109.51 19.31 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.879 HD12 HD21 ' A' 3524 ' ' LEU . 81.1 mt -102.67 116.63 46.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 121.317 0.58 . . . . 0.0 111.325 -172.538 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.718 HG13 ' HD2' ' A' 3573 ' ' TYR . 82.1 t -102.47 115.28 44.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.023 -178.19 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.625 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 64.3 mt -90.9 121.85 41.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -123.68 126.54 46.75 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.722 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.5 m -104.93 110.47 22.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.832 169.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.03 -178.276 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.601 ' CD1' ' HB2' ' A' 3553 ' ' MET . 31.9 m-85 . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.516 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.5 OUTLIER 54.22 -162.97 0.12 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 122.022 0.915 . . . . 0.0 112.16 177.318 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 1.2 p -144.25 116.72 8.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.096 -1.411 . . . . 0.0 108.225 167.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.608 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER -76.18 -133.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.457 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.698 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 20.9 p-10 -97.66 -49.54 4.81 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.951 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 2.7 mp0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.203 -0.903 . . . . 0.0 109.765 176.693 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.701 ' HA ' ' HB3' ' A' 3649 ' ' SER . 13.4 m . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 121.214 0.531 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 20.8 t70 -88.65 113.6 24.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.939 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3498 ' ' MET . . . . . 0.454 ' O ' HD12 ' A' 3502 ' ' LEU . 1.9 mpp? -75.32 -23.77 57.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.742 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 39.6 t -65.71 -24.66 34.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.935 -176.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -81.08 -61.14 2.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.066 0.46 . . . . 0.0 110.679 175.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.512 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.1 pp -66.1 -31.37 72.2 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -171.252 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.64 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.76 -17.32 64.5 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.436 -174.107 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.64 ' N ' HD13 ' A' 3502 ' ' LEU . 22.8 tptm -68.42 -28.15 66.82 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.065 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.418 ' HA ' ' HD2' ' A' 3504 ' ' LYS . 32.0 tptt -103.17 -42.29 5.81 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.257 0.551 . . . . 0.0 109.894 179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.742 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -146.26 97.16 4.45 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.553 -178.219 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -79.67 173.06 13.44 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.573 2.848 . . . . 0.0 113.524 -176.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.535 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.0 mt -73.0 137.2 23.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.132 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.44 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.5 m -105.11 -31.37 2.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.654 -178.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.773 ' HE3' HD12 ' A' 3524 ' ' LEU . 18.2 t90 -145.33 155.69 43.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.793 0.33 . . . . 0.0 110.825 -174.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -150.56 120.6 7.19 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 176.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -174.18 -132.32 1.53 Allowed Glycine 0 N--CA 1.444 -0.818 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -178.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.639 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.4 mp -138.1 155.69 48.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.058 0.456 . . . . 0.0 110.989 178.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.534 HD23 ' HB2' ' A' 3547 ' ' LEU . 91.2 mt -109.03 146.15 34.41 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 169.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.708 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.37 126.84 16.82 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.465 0.174 . . . . 0.0 110.918 -179.224 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.785 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.53 141.4 39.32 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 172.619 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.785 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 62.85 -86.99 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.196 0.598 . . . . 0.0 109.908 -171.532 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 49.4 m-20 -149.81 11.9 0.76 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.185 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.437 ' O ' ' HA ' ' A' 3514 ' ' ALA . 16.5 m-20 -103.0 139.4 38.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.358 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.522 HG22 ' HB2' ' A' 3514 ' ' ALA . 37.5 p -127.12 143.13 51.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.108 0.48 . . . . 0.0 111.71 -175.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -139.55 114.69 9.65 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.396 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.616 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -68.97 120.61 15.11 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 177.563 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.438 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 31.4 m -129.87 148.28 33.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 121.582 0.706 . . . . 0.0 112.181 -174.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -108.72 125.52 52.0 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 114.849 -1.068 . . . . 0.0 108.827 171.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.861 HD21 HD12 ' A' 3659 ' ' ILE . 2.1 mt -93.98 114.2 26.35 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.371 0.605 . . . . 0.0 111.637 -176.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.535 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 48.3 m80 -89.5 142.4 27.7 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.747 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.742 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.1 t80 -70.32 135.28 48.73 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 171.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.604 ' CG1' HD23 ' A' 3575 ' ' LEU . 24.3 t -114.33 -57.0 3.99 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-O 121.467 0.651 . . . . 0.0 110.283 176.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.574 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 66.1 m -160.0 171.21 19.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.111 -172.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 86.3 -152.57 25.61 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.432 -0.89 . . . . 0.0 111.744 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.554 ' HB2' ' HA ' ' A' 3571 ' ' THR . 3.4 t-20 -102.13 117.76 35.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.115 0.458 . . . . 0.0 110.758 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -65.24 -28.56 69.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.176 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3532 ' ' VAL . . . . . 0.4 ' HB ' ' OD1' ' A' 3530 ' ' ASN . 61.0 t -59.52 -33.13 50.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.477 178.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.57 HD23 ' HD3' ' A' 3536 ' ' ARG . 18.7 mt -58.94 -41.55 87.64 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.092 177.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.489 ' HB1' HD12 ' A' 3538 ' ' LEU . . . -69.23 -40.0 78.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.935 0.397 . . . . 0.0 110.361 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -65.45 -32.68 74.42 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.76 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.57 ' HD3' HD23 ' A' 3533 ' ' LEU . 11.2 ptm180 -90.13 -11.63 40.64 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3537 ' ' SER . . . . . . . . . . . . . 26.7 p -104.12 -43.33 5.28 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.542 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.7 HD13 ' HB2' ' A' 3509 ' ' TRP . 35.8 mt -78.82 111.94 23.45 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-O 121.228 0.537 . . . . 0.0 110.033 -172.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3539 ' ' PRO . . . . . 0.513 ' HD3' HG21 ' A' 3614 ' ' VAL . 97.3 Cg_endo -85.26 168.91 10.1 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.101 2.534 . . . . 0.0 112.793 -172.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.7 ' HA ' ' HG3' ' A' 3545 ' ' PRO . 3.8 pp -171.37 164.56 7.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.205 176.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 17.8 t -148.09 -42.55 0.16 Allowed 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 173.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -114.65 -158.9 0.68 Allowed 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.198 -0.91 . . . . 0.0 108.858 171.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . -75.62 59.29 2.93 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.953 -0.641 . . . . 0.0 113.581 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 105.42 107.46 3.22 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.89 173.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.7 ' HG3' ' HA ' ' A' 3540 ' ' LEU . 68.7 Cg_endo -92.12 170.97 2.67 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 123.448 2.765 . . . . 0.0 111.74 170.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.639 ' HA ' ' O ' ' A' 3512 ' ' LEU . 19.6 Cg_endo -95.79 123.65 0.29 Allowed 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 122.976 2.45 . . . . 0.0 113.455 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.647 ' HB3' HD13 ' A' 3612 ' ' ILE . 26.7 mt -79.32 122.98 27.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.637 172.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.708 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -102.84 143.85 31.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 111.816 -174.571 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.517 HG22 HD12 ' B' 2521 ' ' LEU . 21.8 mt -98.93 107.45 20.52 Favored 'Isoleucine or valine' 0 C--O 1.248 0.978 0 CA-C-O 122.251 1.024 . . . . 0.0 111.903 -174.055 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.539 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -114.79 1.96 14.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.972 -174.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.678 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 66.8 mt-30 -148.99 172.47 14.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.476 0.179 . . . . 0.0 111.209 178.05 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.739 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.75 139.91 15.53 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.082 0.468 . . . . 0.0 111.621 -179.273 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.69 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 19.4 ttt -108.17 125.46 51.65 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.352 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -64.0 111.25 2.43 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 177.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.568 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -76.57 98.56 4.71 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 122.413 1.102 . . . . 0.0 109.476 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' 3560 ' ' LEU . 44.1 mt-10 -108.22 159.06 16.91 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.29 176.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -58.64 -41.69 86.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.473 0.654 . . . . 0.0 109.277 175.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3558 ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' 3561 ' ' GLU . 0.7 OUTLIER -62.27 -41.23 98.28 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.827 177.882 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.54 ' O ' HG23 ' A' 3563 ' ' VAL . 17.2 mm-40 -70.28 -41.53 73.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.698 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' 3556 ' ' GLU . 85.4 mt -61.58 -35.31 77.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.501 178.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' 3558 ' ' THR . 45.2 mm-40 -55.28 -51.35 66.94 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.136 172.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.37 -44.39 98.11 Favored Glycine 0 CA--C 1.519 0.29 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.432 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' 3559 ' ' GLN . 57.3 t -59.54 -52.43 61.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.503 0.192 . . . . 0.0 110.616 179.01 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3564 ' ' ALA . . . . . 0.546 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.96 -32.25 71.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.026 0.441 . . . . 0.0 111.046 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.478 ' O ' HG22 ' A' 3568 ' ' THR . 41.8 ttp180 -63.06 -38.27 90.52 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.167 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3566 ' ' ARG . . . . . 0.463 HH22 ' HH ' ' B' 2518 ' ' TYR . 25.2 ptt180 -88.5 -10.86 47.54 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.899 -0.32 . . . . 0.0 111.282 175.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.546 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 65.0 mtp -80.14 -26.55 39.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.975 177.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3568 ' ' THR . . . . . 0.478 HG22 ' O ' ' A' 3565 ' ' ARG . 8.5 t -74.73 -9.43 58.55 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.983 0.42 . . . . 0.0 110.834 -177.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 40.8 t -111.26 87.63 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.302 0.572 . . . . 0.0 110.236 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.15 110.42 4.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.178 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.554 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.6 m 150.94 -40.62 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.747 1.619 . . . . 0.0 107.825 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -80.69 -30.83 36.41 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.629 -179.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.667 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -126.72 166.5 17.28 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.058 178.626 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.622 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 33.7 t -129.27 135.81 49.26 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 171.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.778 HD22 HD13 ' A' 3642 ' ' LEU . 9.4 tp -105.87 124.8 50.15 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 177.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.58 HD11 HD11 ' A' 3661 ' ' ILE . 80.9 mt -125.1 158.1 34.67 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.038 0.447 . . . . 0.0 110.888 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.753 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -125.74 106.9 10.04 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.391 -179.365 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.51 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.61 123.64 38.17 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.324 0.583 . . . . 0.0 110.605 -177.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.473 HD23 ' HB2' ' A' 3656 ' ' HIS . 39.5 mt -126.42 145.05 51.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 114.706 -1.133 . . . . 0.0 109.912 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3580 ' ' PRO . . . . . 0.435 ' HA ' ' O ' ' A' 3521 ' ' ALA . 17.8 Cg_endo -60.23 111.38 0.99 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 122.323 2.016 . . . . 0.0 112.079 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.1 p -96.5 113.22 24.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.16 0.505 . . . . 0.0 109.975 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3582 ' ' GLY . . . . . 0.453 ' HA3' HG22 ' A' 3588 ' ' VAL . . . -96.36 146.15 18.13 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.111 -175.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -73.31 -15.48 61.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.935 0.874 . . . . 0.0 109.417 177.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.643 ' O ' HG23 ' A' 3588 ' ' VAL . 16.7 t70 -158.35 167.03 30.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.113 -1.403 . . . . 0.0 107.22 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -58.62 -40.9 84.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 118.144 0.429 . . . . 0.0 110.47 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.51 -37.23 86.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.513 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.533 ' HB3' ' H ' ' A' 3584 ' ' ASP . 17.1 t70 -63.45 -44.26 95.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.769 178.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' 3584 ' ' ASP . 58.1 t -54.1 -42.52 55.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.727 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 5.4 t -62.75 -49.27 84.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.629 0.728 . . . . 0.0 109.571 -178.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 55.8 m -62.74 -39.9 95.53 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.765 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3591 ' ' GLN . . . . . 0.473 ' HG2' ' O ' ' A' 3587 ' ' ASP . 24.6 mm-40 -70.56 -39.48 73.92 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.358 -0.214 . . . . 0.0 110.972 179.075 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 73.8 m -60.14 -50.32 74.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.842 0.353 . . . . 0.0 111.157 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.537 ' HA ' ' HG2' ' A' 3596 ' ' LYS . 11.4 pt-20 -66.76 -30.89 71.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.166 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 50.5 m -70.54 -40.47 73.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.089 0.471 . . . . 0.0 110.219 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.522 HD12 ' HB2' ' A' 3599 ' ' PHE . 59.5 tp -65.61 -46.16 80.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.09 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.793 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 19.9 ptmt -65.65 -34.39 78.11 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.256 -178.09 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -78.17 -39.19 41.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.671 0.272 . . . . 0.0 111.393 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.49 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -91.05 -46.26 8.23 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -172.066 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.522 ' HB2' HD12 ' A' 3595 ' ' LEU . 19.1 m-85 -99.01 -50.37 4.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.774 0.321 . . . . 0.0 111.533 -174.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.793 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 23.2 mm -61.91 -58.13 8.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.067 -175.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 87.7 m -57.55 -42.54 83.19 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.147 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.797 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -62.43 -57.37 11.5 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 121.366 -0.133 . . . . 0.0 110.979 178.325 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.797 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.1 OUTLIER -57.13 -39.2 74.69 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.58 0.229 . . . . 0.0 111.466 -176.322 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -77.53 -38.13 49.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.748 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.74 -35.56 75.08 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.966 0.413 . . . . 0.0 111.129 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3606 ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' 3602 ' ' TYR . 27.1 mmmt -87.71 -9.09 55.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.931 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 47.33 63.45 1.97 Allowed 'General case' 0 C--O 1.235 0.328 0 O-C-N 123.764 0.665 . . . . 0.0 111.266 -177.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.561 ' O ' HD12 ' A' 3603 ' ' LEU . . . -143.23 -177.42 5.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.009 -0.541 . . . . 0.0 112.027 -175.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.739 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -116.04 118.25 32.37 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.164 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3610 ' ' GLY . . . . . 0.445 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.07 102.73 0.55 Allowed Glycine 0 C--O 1.223 -0.547 0 C-N-CA 120.718 -0.753 . . . . 0.0 111.343 178.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.678 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.6 mm -89.55 123.84 41.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.238 0.542 . . . . 0.0 110.795 -175.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.647 HD13 ' HB3' ' A' 3547 ' ' LEU . 53.8 mt -119.23 106.79 19.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.739 175.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.45 ' HA ' ' O ' ' A' 3624 ' ' TYR . 69.7 m-20 -82.97 106.85 15.14 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 175.206 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.513 HG21 ' HD3' ' A' 3539 ' ' PRO . 9.3 p -109.12 133.52 20.72 Favored Pre-proline 0 C--N 1.312 -1.058 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.143 -171.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.585 ' HB2' ' HA ' ' A' 3620 ' ' ASN . 71.8 Cg_endo -80.13 133.38 9.88 Favored 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 121.995 1.797 . . . . 0.0 111.612 171.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.425 ' HA ' ' HD2' ' A' 3617 ' ' PRO . 11.4 t-20 -55.09 123.07 46.06 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.718 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3617 ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' 3616 ' ' ASN . 11.5 Cg_endo -55.56 107.61 0.26 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.391 2.061 . . . . 0.0 111.434 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 115.79 -48.21 0.96 Allowed Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.599 -177.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 5.7 m -96.82 -20.86 17.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.678 0.239 . . . . 0.0 111.171 -176.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3620 ' ' ASN . . . . . 0.585 ' HA ' ' HB2' ' A' 3615 ' ' PRO . 86.2 m-20 63.7 26.28 14.48 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.782 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.423 ' O ' ' HA ' ' A' 3615 ' ' PRO . 54.0 mt-30 -88.14 111.77 45.12 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.065 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.458 ' HA ' ' O ' ' A' 3614 ' ' VAL . 85.7 Cg_endo -84.87 23.29 0.85 Allowed 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 123.32 2.68 . . . . 0.0 113.565 -173.085 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -82.28 53.4 2.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.772 0.32 . . . . 0.0 111.449 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.45 ' O ' ' HA ' ' A' 3613 ' ' ASN . 79.0 m-85 -143.44 133.78 24.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.061 0.458 . . . . 0.0 110.52 178.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.455 HG13 HD12 ' A' 3611 ' ' ILE . 15.5 t -113.39 114.28 46.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.972 176.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.626 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.4 mp -100.41 113.44 26.2 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.483 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 14.3 mt-30 -94.68 110.38 22.22 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.647 -178.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.589 HG12 HG12 ' A' 3659 ' ' ILE . 40.5 mt -91.82 98.19 8.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.072 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -88.58 141.71 30.49 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.297 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.649 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 57.2 Cg_endo -71.31 164.6 35.2 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.572 2.182 . . . . 0.0 111.504 176.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.26 85.86 0.33 Allowed 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.799 2.333 . . . . 0.0 112.016 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3632 ' ' CYS . . . . . 0.55 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.1 p -112.4 162.12 15.92 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.002 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -55.74 -33.78 64.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.684 0.278 . . . . 0.0 110.305 179.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.97 -42.58 80.65 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.084 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3635 ' ' SER . . . . . 0.464 ' O ' ' HG ' ' A' 3639 ' ' LEU . 58.7 p -65.32 -52.55 53.22 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.105 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3636 ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' A' 3632 ' ' CYS . 5.6 mm-40 -63.68 -35.53 80.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.402 -175.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 14.3 p -64.56 -54.69 28.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.606 -176.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -71.34 -19.47 62.29 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 118.871 -1.132 . . . . 0.0 110.733 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3639 ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' 3635 ' ' SER . 41.9 mt -64.9 -35.84 82.44 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.23 172.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.534 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 18.1 m -70.31 -31.83 69.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.423 0.63 . . . . 0.0 109.941 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -76.06 -43.92 41.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.849 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.778 HD13 HD22 ' A' 3575 ' ' LEU . 17.9 mt -85.21 -38.96 18.34 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.512 -0.767 . . . . 0.0 112.753 -172.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -147.85 82.92 7.66 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.899 0.381 . . . . 0.0 111.556 -177.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.59 -28.06 21.74 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.069 2.513 . . . . 0.0 113.882 -174.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 4.2 t0 -77.73 -37.93 48.19 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.33 -172.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.753 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -80.03 -31.17 39.57 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 175.184 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.534 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.04 -43.69 70.39 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.452 177.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -62.05 -25.76 67.87 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.382 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.701 ' HB3' ' HA ' ' A' 3496 ' ' VAL . 73.3 m -78.92 -40.23 32.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.026 0.441 . . . . 0.0 110.598 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.861 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.8 pt -82.79 -18.32 10.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.818 -172.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.9 t -59.08 -25.69 63.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -88.84 -35.0 16.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.919 0.39 . . . . 0.0 110.617 174.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.861 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.4 OUTLIER -98.84 30.97 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 122.81 1.291 . . . . 0.0 109.083 -175.56 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.427 ' N ' ' HD2' ' A' 3655 ' ' PRO . 18.7 m -30.03 -42.88 0.2 Allowed Pre-proline 0 CA--C 1.542 0.657 0 CA-C-N 113.763 -1.562 . . . . 0.0 114.851 173.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.431 ' HG2' HD13 ' A' 3653 ' ' ILE . 15.9 Cg_endo -60.55 65.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.849 1.699 . . . . 0.0 112.345 168.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3656 ' ' HIS . . . . . 0.473 ' HB2' HD23 ' A' 3579 ' ' LEU . 23.6 p80 -136.37 174.15 10.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.866 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.525 HD22 HG22 ' A' 3628 ' ' ILE . 31.6 mt -119.93 149.12 42.63 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.765 0.317 . . . . 0.0 110.853 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 51.8 ttp -112.88 110.94 21.35 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.861 HD12 HD21 ' A' 3524 ' ' LEU . 71.0 mt -105.63 118.35 52.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.153 0.501 . . . . 0.0 111.42 -172.125 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.667 HG13 ' HD2' ' A' 3573 ' ' TYR . 77.2 t -103.18 116.76 47.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.805 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.626 HG12 ' HG ' ' A' 3626 ' ' LEU . 59.1 mt -90.95 114.98 29.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.11 127.94 56.35 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.852 0.358 . . . . 0.0 111.443 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 8.5 m -70.1 137.94 51.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.831 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.518 179.154 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.491 ' CD1' ' HB2' ' A' 3553 ' ' MET . 38.1 m-85 . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' A' 3551 ' ' GLN . 1.3 tp10 55.29 -160.81 0.17 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.139 0.495 . . . . 0.0 110.897 175.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 7.7 p -144.2 129.9 19.19 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 167.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.575 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER -82.6 -126.21 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.517 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 2523 ' ' ASP . . . . . 0.425 ' CG ' ' H ' ' B' 2524 ' ' SEP . 9.0 t70 -161.3 -156.19 0.44 Allowed 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -175.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B 2524 ' ' SEP . . . . . 0.425 ' H ' ' CG ' ' B' 2523 ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.03 177.3 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.574 ' HB ' ' OE1' ' A' 3500 ' ' GLN . 34.0 m . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 33.8 t70 -80.59 147.65 30.65 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.737 -0.21 . . . . 0.0 110.689 -177.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3498 ' ' MET . . . . . 0.452 ' HA ' ' CD2' ' A' 3501 ' ' LEU . 73.6 mtm -62.87 -30.72 71.73 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -178.242 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.529 ' HA ' HD12 ' A' 3502 ' ' LEU . 88.8 t -64.76 -22.32 31.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.604 0.716 . . . . 0.0 110.468 177.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3500 ' ' GLN . . . . . 0.574 ' OE1' ' HB ' ' A' 3496 ' ' VAL . 51.8 mt-30 -79.21 -52.07 8.65 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.508 174.683 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.526 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp -67.29 -35.28 79.14 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -173.06 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.709 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -73.12 -15.53 61.48 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.098 -0.641 . . . . 0.0 110.477 -174.202 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.59 ' N ' HD13 ' A' 3502 ' ' LEU . 55.5 tptt -68.13 -28.33 67.22 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 175.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.452 ' HB3' ' CE2' ' A' 3505 ' ' TYR . 4.3 mmmm -92.26 -42.96 9.55 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.776 175.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.729 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -153.5 108.6 2.57 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.812 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3506 ' ' PRO . . . . . 0.709 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 94.0 Cg_endo -87.49 173.55 5.38 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 124.127 3.218 . . . . 0.0 114.025 -175.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.429 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.3 mt -72.11 132.71 33.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.61 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.462 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.0 m -103.4 -31.15 2.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.596 -177.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.722 ' HB2' HD13 ' A' 3538 ' ' LEU . 47.3 t90 -147.56 153.64 39.7 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -175.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3510 ' ' GLN . . . . . 0.476 ' HG3' ' HB3' ' A' 3523 ' ' GLN . 21.7 tt0 -151.25 120.01 6.57 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -176.13 -123.29 0.76 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.676 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.5 mp -141.04 157.12 45.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.059 0.457 . . . . 0.0 111.059 179.156 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.444 ' HG ' HG21 ' A' 3522 ' ' VAL . 92.3 mt -108.91 151.29 26.48 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 168.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.739 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -147.65 126.92 13.02 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.74 0.305 . . . . 0.0 111.465 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.748 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.28 141.84 41.95 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 172.914 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.809 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.6 OUTLIER 63.6 -92.12 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -169.446 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 11.5 m120 -147.22 15.1 1.15 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 172.562 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.487 ' O ' ' HA ' ' A' 3514 ' ' ALA . 4.9 m-20 -96.02 123.26 39.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.361 -176.192 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.494 HG22 ' HB2' ' A' 3514 ' ' ALA . 37.0 p -113.75 138.77 49.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.074 0.464 . . . . 0.0 111.63 -177.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.97 116.11 14.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.473 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.644 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.73 122.94 20.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.97 0.414 . . . . 0.0 110.333 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.444 HG21 ' HG ' ' A' 3513 ' ' LEU . 35.2 m -132.43 149.03 31.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.915 -175.366 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3523 ' ' GLN . . . . . 0.476 ' HB3' ' HG3' ' A' 3510 ' ' GLN . 17.4 pt20 -112.45 127.59 56.08 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 170.006 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.887 HD21 HD12 ' A' 3659 ' ' ILE . 1.2 mt -95.35 113.3 24.95 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.039 -174.601 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.429 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 80.2 m-70 -88.0 136.31 33.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.714 175.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.729 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.1 t80 -67.67 139.55 56.78 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 174.136 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.572 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.5 t -115.1 -58.11 3.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 121.387 0.613 . . . . 0.0 110.979 176.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.44 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 65.0 m -159.69 171.91 18.7 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.275 -171.569 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.36 -152.02 23.11 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.632 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.59 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.6 t-20 -100.24 112.89 25.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.843 0.354 . . . . 0.0 110.608 -178.223 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -64.67 -32.08 73.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.495 -176.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 39.9 t -59.47 -32.37 48.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.42 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.46 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 20.3 mt -58.42 -45.81 87.69 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.775 176.12 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -66.6 -40.84 89.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.112 0.482 . . . . 0.0 110.076 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 14.7 t60 -57.57 -41.73 81.68 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.707 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -89.19 -14.32 36.32 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -176.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.451 ' O ' HG21 ' A' 3614 ' ' VAL . 42.4 p -96.81 -39.25 9.52 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 121.981 -0.449 . . . . 0.0 111.617 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.722 HD13 ' HB2' ' A' 3509 ' ' TRP . 31.1 mt -80.43 108.65 10.21 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-O 120.926 0.393 . . . . 0.0 109.978 -175.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -74.9 147.49 34.45 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.854 2.369 . . . . 0.0 113.06 -171.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.496 HD23 ' CD1' ' A' 3509 ' ' TRP . 3.2 pp -175.51 154.78 1.69 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.251 178.131 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 13.3 m -135.64 -40.7 0.7 Allowed 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.826 -1.079 . . . . 0.0 108.206 170.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -146.6 98.23 3.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.438 173.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 93.35 -107.16 3.5 Favored Glycine 0 N--CA 1.442 -0.933 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 -174.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 175.59 112.96 0.31 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.261 -0.971 . . . . 0.0 113.059 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.39 150.79 70.89 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 123.138 2.559 . . . . 0.0 111.729 176.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.676 ' HA ' ' O ' ' A' 3512 ' ' LEU . 34.8 Cg_endo -64.01 124.75 14.01 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 C-N-CA 122.691 2.261 . . . . 0.0 113.439 -175.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.688 ' HB3' HD13 ' A' 3612 ' ' ILE . 29.1 mt -69.24 124.18 23.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.84 173.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.739 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -105.05 142.49 34.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.782 0.325 . . . . 0.0 111.773 -173.903 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.557 HG22 HD12 ' B' 2521 ' ' LEU . 34.9 mt -98.89 107.03 19.76 Favored 'Isoleucine or valine' 0 C--O 1.254 1.298 0 CA-C-O 122.608 1.194 . . . . 0.0 112.069 -172.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.435 ' HA ' ' HB2' ' B' 2523 ' ' ASP . . . -107.34 -9.04 16.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.614 -1.175 . . . . 0.0 111.949 -173.463 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.657 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 58.8 mt-30 -146.29 175.2 10.7 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.951 -0.113 . . . . 0.0 110.859 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.686 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.32 137.0 13.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.87 0.367 . . . . 0.0 111.353 -179.558 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.64 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 13.6 tmm? -108.17 113.79 27.19 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.174 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3554 ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' 3556 ' ' GLU . 14.1 mmt180 -62.52 110.34 1.66 Allowed 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 175.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.494 ' O ' HD12 ' A' 3555 ' ' LEU . 2.3 pp -68.29 97.96 0.78 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.304 1.05 . . . . 0.0 109.809 -173.634 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.622 ' O ' ' HG ' ' A' 3560 ' ' LEU . 41.5 mt-10 -95.34 154.41 17.21 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.256 -1.338 . . . . 0.0 109.482 -178.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.612 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.49 -42.68 74.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.22 0.534 . . . . 0.0 109.725 174.047 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 19.3 m -63.26 -41.5 99.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.945 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.585 ' O ' HG23 ' A' 3563 ' ' VAL . 27.7 mm-40 -62.97 -48.34 79.29 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.435 177.262 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' 3556 ' ' GLU . 69.5 mt -59.02 -35.87 74.0 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.288 0.367 . . . . 0.0 110.873 -178.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.9 mm-40 -57.97 -51.72 68.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.428 0.632 . . . . 0.0 110.497 174.13 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -63.95 -40.1 97.95 Favored Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.226 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.664 ' O ' ' HG3' ' A' 3567 ' ' MET . 73.2 t -59.62 -48.18 88.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 176.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -53.67 -42.7 68.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.196 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.569 ' O ' ' HB ' ' A' 3568 ' ' THR . 96.4 mtt180 -60.42 -44.46 95.74 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.851 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -76.55 -15.3 59.9 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.087 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.664 ' HG3' ' O ' ' A' 3563 ' ' VAL . 88.0 mtp -83.74 -19.19 35.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.687 0.756 . . . . 0.0 109.126 173.016 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3568 ' ' THR . . . . . 0.569 ' HB ' ' O ' ' A' 3565 ' ' ARG . 56.2 m -77.06 -21.59 54.23 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.009 176.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 60.5 t -116.45 84.51 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.9 177.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.0 108.13 3.4 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.59 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 1.9 m 157.88 -42.99 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.249 1.42 . . . . 0.0 108.02 -173.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -84.8 -17.36 38.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.025 -177.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.724 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -138.17 163.9 30.54 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 120.979 0.419 . . . . 0.0 109.994 177.401 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.631 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 29.3 t -126.12 135.64 51.94 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 172.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.746 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.97 125.54 51.11 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.603 HD11 HD11 ' A' 3661 ' ' ILE . 82.2 mt -126.72 154.89 43.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.11 0.481 . . . . 0.0 110.837 -177.364 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.608 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.83 108.02 13.43 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.611 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.488 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.68 122.42 37.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.299 0.571 . . . . 0.0 110.495 -177.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.457 ' HG ' HD12 ' A' 3577 ' ' LEU . 83.4 mt -126.75 142.01 42.08 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.688 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3580 ' ' PRO . . . . . 0.495 ' HA ' ' O ' ' A' 3521 ' ' ALA . 20.5 Cg_endo -60.46 117.3 4.05 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 122.67 2.247 . . . . 0.0 112.091 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.4 p -101.58 107.8 19.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.272 0.558 . . . . 0.0 111.003 -177.074 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.71 146.18 16.34 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.604 -179.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 5.2 ttp85 -64.72 -35.29 80.57 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.596 0.712 . . . . 0.0 110.064 176.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.598 ' O ' HG23 ' A' 3588 ' ' VAL . 15.1 t70 -134.92 164.37 27.75 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -55.42 -38.38 68.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 117.994 0.361 . . . . 0.0 110.392 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -62.2 -44.64 96.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.507 176.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.456 ' HB3' ' H ' ' A' 3584 ' ' ASP . 24.4 t0 -63.71 -40.87 97.84 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.013 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' 3584 ' ' ASP . 91.4 t -57.04 -48.55 81.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.043 176.525 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 65.5 t -57.36 -48.73 82.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.348 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 48.0 t -54.86 -53.34 56.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.097 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -66.25 -36.11 82.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.387 -177.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 78.7 m -60.73 -50.94 71.47 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 176.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.524 ' HA ' ' HD3' ' A' 3596 ' ' LYS . 39.5 tp10 -61.3 -44.45 97.19 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.005 -178.607 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 37.5 m -61.36 -45.34 94.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.69 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.559 HD12 ' HB2' ' A' 3599 ' ' PHE . 59.5 tp -60.85 -42.77 98.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.429 178.153 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.568 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 50.2 mtpt -55.78 -54.16 47.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.853 177.316 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.79 -40.67 88.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.274 -176.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -89.93 -46.86 8.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -169.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.559 ' HB2' HD12 ' A' 3595 ' ' LEU . 22.3 m-85 -99.56 -50.43 4.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.753 0.311 . . . . 0.0 111.515 -175.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.568 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.0 mm -61.32 -54.39 35.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.717 -176.116 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 45.8 m -59.89 -41.12 90.89 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.267 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.702 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -65.98 -57.03 8.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.906 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.702 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.3 OUTLIER -56.8 -43.61 81.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -177.578 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -69.63 -35.83 75.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.491 -176.739 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -67.86 -38.89 83.68 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.105 0.478 . . . . 0.0 110.659 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -78.81 -18.04 54.73 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.627 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 87.1 mt-30 49.67 53.7 12.28 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -169.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.521 ' O ' HD12 ' A' 3603 ' ' LEU . . . -133.94 -175.89 3.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.044 -170.105 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.686 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.38 118.32 30.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.411 175.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3610 ' ' GLY . . . . . 0.493 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.77 104.03 0.79 Allowed Glycine 0 C--O 1.221 -0.707 0 C-N-CA 120.718 -0.753 . . . . 0.0 111.292 177.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.657 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 38.9 mm -90.12 122.45 41.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 121.333 0.587 . . . . 0.0 111.439 -173.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.688 HD13 ' HB3' ' A' 3547 ' ' LEU . 51.1 mt -119.71 111.56 33.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.221 176.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.4 m-20 -87.46 125.59 34.39 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.451 HG21 ' O ' ' A' 3537 ' ' SER . 5.3 p -130.38 128.72 22.7 Favored Pre-proline 0 C--N 1.315 -0.919 0 CA-C-O 121.02 0.438 . . . . 0.0 111.262 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.598 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 61.7 Cg_endo -75.55 142.4 26.19 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.576 2.184 . . . . 0.0 112.102 175.569 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.46 ' OD1' ' HB2' ' A' 3619 ' ' SER . 2.6 t-20 -103.11 100.89 18.75 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 175.322 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -35.71 93.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 125.074 3.849 . . . . 0.0 115.316 -168.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 58.5 12.38 13.1 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.523 -0.762 . . . . 0.0 113.651 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3619 ' ' SER . . . . . 0.46 ' HB2' ' OD1' ' A' 3616 ' ' ASN . 15.0 m -106.28 -19.31 13.74 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.741 -0.27 . . . . 0.0 111.307 -174.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 8.6 t30 -157.72 -75.96 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.456 178.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.588 ' HG2' ' HD2' ' A' 3622 ' ' PRO . 0.9 OUTLIER 170.61 168.29 0.2 Allowed Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -172.983 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.598 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 44.1 Cg_endo -75.06 21.73 0.43 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.696 2.264 . . . . 0.0 111.44 165.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3623 ' ' ALA . . . . . 0.485 ' HB1' HG23 ' A' 3664 ' ' VAL . . . -84.36 41.38 0.83 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.961 -176.279 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.517 ' O ' ' HA ' ' A' 3613 ' ' ASN . 86.4 m-85 -120.51 131.83 54.9 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.703 177.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.477 HG12 ' HG3' ' A' 3627 ' ' GLN . 4.1 t -122.23 113.16 37.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.902 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.66 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -94.46 111.34 23.09 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 170.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.487 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 63.0 mt-30 -94.4 110.66 22.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.76 -177.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.607 HG12 HG12 ' A' 3659 ' ' ILE . 32.8 mt -90.87 97.84 7.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.086 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -86.29 141.2 34.63 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.984 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.655 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 60.7 Cg_endo -72.92 169.69 21.52 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.486 2.124 . . . . 0.0 111.361 176.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.03 77.63 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.441 2.094 . . . . 0.0 111.64 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3632 ' ' CYS . . . . . 0.537 ' O ' ' HG2' ' A' 3636 ' ' GLU . 10.4 p -112.88 162.64 15.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.044 -174.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -45.99 -39.75 9.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.469 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 46.6 t80 -61.52 -52.98 62.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.495 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 56.4 p -66.37 -54.77 20.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.927 -175.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3636 ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' 3632 ' ' CYS . 5.3 mm-40 -59.39 -38.56 80.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.268 -173.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 39.0 t -66.33 -50.11 64.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.752 0.311 . . . . 0.0 110.667 -178.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 61.8 m80 -65.81 -31.81 72.99 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.42 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.92 -30.98 72.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.956 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.763 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 20.1 m -74.84 -31.46 61.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.323 0.582 . . . . 0.0 109.89 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -79.61 -47.2 15.86 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.932 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.746 HD13 HD22 ' A' 3575 ' ' LEU . 14.7 mt -79.36 -41.8 27.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.139 -173.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -138.2 72.08 46.28 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -174.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -64.71 -19.29 64.47 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.207 1.938 . . . . 0.0 112.014 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3645 ' ' ASP . . . . . 0.473 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 6.6 m-20 -67.84 -60.78 2.25 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.559 -178.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.608 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -77.15 -26.42 53.03 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.635 -178.27 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.763 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.18 -44.12 71.27 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.231 177.01 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.99 -18.07 63.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.47 -178.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 17.9 m -89.62 -36.76 15.1 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.052 0.453 . . . . 0.0 110.545 177.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.777 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.2 pt -83.11 -10.5 11.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.785 -174.268 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.4 p -60.06 -25.18 65.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.958 0.408 . . . . 0.0 110.402 176.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -83.93 -41.87 16.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.313 0.577 . . . . 0.0 110.011 173.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.777 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.3 OUTLIER -99.57 34.21 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-O 123.184 1.469 . . . . 0.0 109.094 -172.366 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.45 ' N ' ' HD2' ' A' 3655 ' ' PRO . 23.2 m -34.67 -43.99 0.59 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 113.529 -1.669 . . . . 0.0 114.489 173.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' 3654 ' ' SER . 15.8 Cg_endo -60.19 86.05 0.07 OUTLIER 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.656 1.571 . . . . 0.0 111.821 170.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 3.8 p-80 -152.12 178.29 9.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.488 -176.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.501 ' HB3' HG23 ' A' 3628 ' ' ILE . 42.2 mt -126.9 133.62 50.63 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.474 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 60.1 ttp -97.32 109.99 22.63 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.887 HD12 HD21 ' A' 3524 ' ' LEU . 92.3 mt -100.59 116.74 44.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.28 0.562 . . . . 0.0 111.459 -173.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.724 HG13 ' HD2' ' A' 3573 ' ' TYR . 93.2 t -102.84 113.0 38.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.97 -178.443 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.66 HG12 ' HG ' ' A' 3626 ' ' LEU . 53.6 mt -90.78 113.13 26.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.294 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.62 127.98 55.91 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.687 0.279 . . . . 0.0 111.07 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 11.7 p -95.85 110.94 23.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.056 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A 3664 ' ' VAL . . . . . 0.485 HG23 ' HB1' ' A' 3623 ' ' ALA . 6.9 m . . . . . 0 C--O 1.248 0.98 0 CA-C-O 119.409 -0.329 . . . . 0.0 111.074 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.571 ' CD1' ' HB2' ' A' 3553 ' ' MET . 20.3 m-85 . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.577 ' CG ' ' H ' ' B' 2520 ' ' THR . 8.6 tt0 55.98 -158.24 0.23 Allowed 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 175.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.577 ' H ' ' CG ' ' B' 2519 ' ' GLU . 88.9 m -151.78 123.65 8.03 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 174.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.624 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.1 OUTLIER -79.71 -119.1 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -178.328 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.809 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B 2523 ' ' ASP . . . . . 0.435 ' HB2' ' HA ' ' A' 3550 ' ' ALA . 21.7 t70 -110.21 174.33 5.91 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.331 -1.304 . . . . 0.0 112.744 -158.622 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.485 -0.769 . . . . 0.0 109.919 174.241 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.59 ' CG2' ' HA ' ' A' 3649 ' ' SER . 3.1 m . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 121.451 0.643 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -90.89 153.87 19.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.036 -174.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3498 ' ' MET . . . . . 0.415 ' O ' HD12 ' A' 3502 ' ' LEU . 56.5 mtp -63.58 -23.3 67.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.493 176.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.455 ' HA ' HD12 ' A' 3502 ' ' LEU . 45.6 t -62.3 -24.58 35.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.356 -178.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -82.29 -52.78 6.6 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.974 0.416 . . . . 0.0 110.362 176.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.613 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.7 pp -66.25 -37.08 84.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.139 -173.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.64 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -71.31 -15.76 62.42 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.192 -173.31 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.64 ' N ' HD13 ' A' 3502 ' ' LEU . 23.5 tptm -69.59 -27.06 64.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.273 177.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.713 ' HD3' ' CE2' ' A' 3505 ' ' TYR . 32.5 tttt -100.37 -42.02 6.8 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.475 179.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.713 ' CE2' ' HD3' ' A' 3504 ' ' LYS . 0.1 OUTLIER -146.71 106.9 4.02 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.308 177.038 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -86.52 174.01 6.09 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 124.27 3.313 . . . . 0.0 113.886 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.559 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 95.2 mt -72.05 138.79 20.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.118 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.439 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.7 m -105.94 -28.17 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.785 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.649 ' HB2' HD13 ' A' 3538 ' ' LEU . 21.1 t90 -153.54 154.75 34.89 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -176.549 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -151.14 121.4 7.27 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.117 0.484 . . . . 0.0 110.126 178.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -171.75 -123.94 0.73 Allowed Glycine 0 N--CA 1.441 -0.997 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.662 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.1 mp -141.34 158.76 43.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.1 0.476 . . . . 0.0 111.094 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.452 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.5 mt -112.79 151.46 30.32 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 168.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.668 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.75 125.93 14.66 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.729 0.3 . . . . 0.0 111.575 -178.359 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.788 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.02 142.59 38.25 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 173.119 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.829 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.5 OUTLIER 59.88 -94.93 0.05 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.119 0.485 . . . . 0.0 110.157 -171.268 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -136.47 4.78 2.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.192 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.429 ' O ' ' HA ' ' A' 3514 ' ' ALA . 47.8 m-20 -102.53 138.54 39.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.333 -172.79 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.537 HG22 ' HB2' ' A' 3514 ' ' ALA . 27.8 p -127.02 138.04 53.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.943 -179.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -133.83 119.97 19.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.08 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.662 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -71.92 120.19 17.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.049 0.452 . . . . 0.0 110.52 178.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.433 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 33.7 m -132.06 147.76 32.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.857 -175.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -110.95 129.9 55.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.838 172.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.886 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -98.09 110.67 23.21 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.356 0.598 . . . . 0.0 111.886 -175.51 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.559 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 54.8 m-70 -84.99 137.11 33.28 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.56 175.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.707 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.7 t80 -67.08 136.38 55.1 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 173.772 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.563 ' CG1' HD23 ' A' 3575 ' ' LEU . 18.8 t -115.11 -55.89 4.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.42 0.629 . . . . 0.0 110.798 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.415 ' OG ' HD22 ' A' 3642 ' ' LEU . 48.0 t -159.04 171.72 19.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.708 -172.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.42 -150.22 21.14 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.766 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.7 t-20 -104.87 110.33 22.65 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -61.64 -29.6 70.17 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.544 -176.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3532 ' ' VAL . . . . . 0.538 ' HB ' ' OD1' ' A' 3530 ' ' ASN . 60.9 t -60.55 -33.46 54.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.364 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.552 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 20.4 mt -57.37 -41.46 80.21 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.944 176.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.519 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.76 -45.62 77.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.847 0.356 . . . . 0.0 110.462 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -60.99 -33.88 73.93 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.187 -178.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.403 ' HD3' HD23 ' A' 3533 ' ' LEU . 15.5 ptm180 -90.01 -13.91 35.04 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -178.339 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.458 ' HB2' HD11 ' A' 3626 ' ' LEU . 66.5 p -101.87 -34.72 9.28 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 122.014 -0.429 . . . . 0.0 111.317 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.649 HD13 ' HB2' ' A' 3509 ' ' TRP . 26.9 mt -80.44 114.08 44.57 Favored Pre-proline 0 C--N 1.319 -0.72 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -177.175 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -78.4 152.66 26.88 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.073 2.515 . . . . 0.0 113.431 -169.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 1.3 pt? -154.85 130.9 10.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.567 177.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 42.5 t -148.19 6.53 0.77 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.207 0.527 . . . . 0.0 110.675 -176.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3542 ' ' GLU . . . . . 0.787 ' HG3' ' H ' ' A' 3543 ' ' GLY . 4.3 pt-20 -163.57 -77.28 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.261 -173.029 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3543 ' ' GLY . . . . . 0.787 ' H ' ' HG3' ' A' 3542 ' ' GLU . . . -131.43 -61.56 0.09 OUTLIER Glycine 0 C--N 1.312 -0.797 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.863 173.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -168.22 85.97 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 111.491 -0.644 . . . . 0.0 111.491 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.56 132.81 36.96 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.885 2.39 . . . . 0.0 112.449 -177.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.603 ' HA ' ' O ' ' A' 3512 ' ' LEU . 37.1 Cg_endo -67.03 126.51 15.3 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.75 2.3 . . . . 0.0 112.801 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.729 ' HB3' HD13 ' A' 3612 ' ' ILE . 37.9 mt -68.82 118.09 11.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.4 178.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.668 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.1 OUTLIER -94.24 133.75 37.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.199 0.523 . . . . 0.0 111.439 -178.116 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.63 HG22 HD12 ' B' 2521 ' ' LEU . 23.1 mt -84.49 108.05 16.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-O 122.185 0.993 . . . . 0.0 110.75 -177.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -105.01 -12.31 16.23 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.594 -1.184 . . . . 0.0 111.733 -171.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.652 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 87.5 mt-30 -150.36 177.55 9.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.54 -177.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.724 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.32 141.7 19.64 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 120.693 0.282 . . . . 0.0 111.411 179.495 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.629 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.5 tmm? -109.75 109.03 19.6 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 175.144 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3554 ' ' ARG . . . . . 0.445 ' O ' ' HG3' ' A' 3556 ' ' GLU . 49.1 mtt180 -58.97 110.97 1.14 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' 3555 ' ' LEU . 2.3 pp -68.39 99.18 0.91 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 122.304 1.049 . . . . 0.0 110.56 -173.538 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.523 ' O ' ' HG ' ' A' 3560 ' ' LEU . 33.9 mt-10 -103.04 157.76 16.77 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.081 176.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.508 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.91 -50.53 70.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.622 0.249 . . . . 0.0 110.908 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 25.6 p -62.19 -39.66 93.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.988 0.423 . . . . 0.0 111.255 178.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.519 ' O ' HG23 ' A' 3563 ' ' VAL . 57.5 mm-40 -65.97 -41.13 91.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.563 -178.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.54 HD21 ' HB2' ' A' 3555 ' ' LEU . 83.7 mt -64.24 -34.78 78.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.779 0.323 . . . . 0.0 110.809 -179.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' 3557 ' ' ALA . 12.1 mm-40 -68.66 -41.66 79.0 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 174.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -57.8 -41.51 94.04 Favored Glycine 0 CA--C 1.517 0.164 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.796 175.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.561 ' O ' ' HG3' ' A' 3567 ' ' MET . 95.5 t -61.7 -51.38 73.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 174.327 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3564 ' ' ALA . . . . . 0.515 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.63 -24.05 63.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.903 -178.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -61.15 -40.02 92.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.88 0.371 . . . . 0.0 110.536 -179.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3566 ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' 3566 ' ' ARG . 9.9 ptp180 -87.99 -14.69 38.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.998 0.427 . . . . 0.0 110.569 176.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.561 ' HG3' ' O ' ' A' 3563 ' ' VAL . 84.9 mtp -74.68 -19.9 60.08 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.188 -178.029 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 14.7 t -89.01 3.29 52.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.112 0.482 . . . . 0.0 110.078 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 28.1 t -125.99 91.27 1.75 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.52 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -67.56 110.23 3.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.349 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.557 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 144.19 -38.98 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.561 1.544 . . . . 0.0 108.583 -177.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -82.19 -20.65 37.39 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.782 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.747 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -144.38 165.55 27.59 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.195 176.876 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.608 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 37.2 t -127.8 135.99 50.85 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 170.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.792 HD22 HD13 ' A' 3642 ' ' LEU . 14.7 tp -106.46 125.45 51.01 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.59 HD11 HD11 ' A' 3661 ' ' ILE . 78.7 mt -126.57 153.44 45.23 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.203 0.525 . . . . 0.0 110.558 -178.367 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.621 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.0 108.12 13.92 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.974 -0.751 . . . . 0.0 108.974 -179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.485 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 121.18 35.67 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.363 0.601 . . . . 0.0 110.449 -177.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.43 ' HG ' HD12 ' A' 3577 ' ' LEU . 68.2 mt -121.04 144.11 38.55 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 114.744 -1.117 . . . . 0.0 110.142 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.09 109.9 0.91 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.215 1.944 . . . . 0.0 111.705 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 18.2 p -95.96 115.72 27.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.208 0.528 . . . . 0.0 110.2 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3582 ' ' GLY . . . . . 0.442 ' HA3' HG22 ' A' 3588 ' ' VAL . . . -102.38 145.87 16.66 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.432 -0.889 . . . . 0.0 112.963 -176.041 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -19.35 63.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.827 0.822 . . . . 0.0 109.689 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.66 ' O ' HG23 ' A' 3588 ' ' VAL . 31.7 t70 -156.97 164.41 38.05 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -57.17 -35.57 69.71 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.021 0.439 . . . . 0.0 110.351 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.53 -41.52 79.8 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.778 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.541 ' HB3' ' H ' ' A' 3584 ' ' ASP . 13.9 t70 -61.94 -40.53 95.87 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.362 177.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' 3584 ' ' ASP . 58.6 t -57.18 -45.04 84.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.271 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.325 178.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 7.1 t -62.31 -53.66 44.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.472 0.653 . . . . 0.0 109.616 -178.054 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 53.6 m -54.55 -48.88 71.49 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.601 178.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -68.89 -34.28 75.15 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -179.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 87.0 m -61.06 -46.77 89.34 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.851 -0.339 . . . . 0.0 110.115 177.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -64.84 -45.08 87.6 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.979 179.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 70.4 m -53.52 -43.45 68.32 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.736 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.538 HD12 ' HB2' ' A' 3599 ' ' PHE . 53.4 tp -67.86 -44.09 77.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.719 177.516 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.593 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 49.6 mtpt -57.98 -57.99 10.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.894 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -63.01 -34.68 78.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.606 -177.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.84 -47.43 6.15 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -171.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.538 ' HB2' HD12 ' A' 3595 ' ' LEU . 17.2 m-85 -99.62 -50.75 3.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.736 0.303 . . . . 0.0 111.529 -174.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.4 mm -61.5 -50.88 78.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.424 -176.464 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 60.4 m -58.73 -50.01 75.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.518 178.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.675 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.2 OUTLIER -59.75 -58.67 7.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.561 -178.913 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.675 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.4 OUTLIER -54.59 -41.35 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -176.679 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -79.28 -37.37 37.97 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.707 -176.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.29 -39.73 81.99 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.007 0.432 . . . . 0.0 111.185 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3606 ' ' LYS . . . . . 0.448 ' HG3' ' CD1' ' A' 3602 ' ' TYR . 21.6 mmmt -81.51 -15.79 53.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.928 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 52.79 65.42 1.52 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.338 -173.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.623 ' O ' HD12 ' A' 3603 ' ' LEU . . . -146.15 -174.6 4.48 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.916 0.388 . . . . 0.0 111.801 -175.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.724 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -121.81 118.75 29.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.65 177.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3610 ' ' GLY . . . . . 0.533 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.98 103.15 0.66 Allowed Glycine 0 C--O 1.221 -0.661 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.833 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.652 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 39.7 mm -89.38 120.9 38.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 121.312 0.577 . . . . 0.0 111.092 -174.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.729 HD13 ' HB3' ' A' 3547 ' ' LEU . 32.8 mt -120.52 107.43 20.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.862 176.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.449 ' HA ' ' O ' ' A' 3624 ' ' TYR . 48.9 m-80 -82.54 127.0 32.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.868 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' 3622 ' ' PRO . 35.0 m -122.68 147.45 50.66 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.618 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.431 ' HA ' ' O ' ' A' 3621 ' ' GLN . 72.0 Cg_endo -92.15 135.81 1.55 Allowed 'Trans proline' 0 N--CA 1.444 -1.419 0 C-N-CA 122.517 2.144 . . . . 0.0 111.957 171.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.501 ' HB2' ' CE2' ' A' 3624 ' ' TYR . 9.5 t30 -69.36 113.05 14.03 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.17 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -51.83 114.61 1.68 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 123.661 2.907 . . . . 0.0 112.945 -176.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 108.66 -31.07 8.1 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.382 -179.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 3.4 m -103.05 -22.88 13.72 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.741 0.305 . . . . 0.0 110.524 -178.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 66.9 t30 63.32 18.41 10.98 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.962 179.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.431 ' O ' ' HA ' ' A' 3615 ' ' PRO . 30.0 tt0 -90.67 112.15 51.65 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.532 -177.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.463 ' HA ' ' O ' ' A' 3614 ' ' VAL . 89.9 Cg_endo -85.57 23.5 0.83 Allowed 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 123.158 2.572 . . . . 0.0 112.973 -177.243 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -82.3 48.15 1.24 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.048 0.452 . . . . 0.0 111.094 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.501 ' CE2' ' HB2' ' A' 3616 ' ' ASN . 72.0 m-85 -132.57 133.13 43.32 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.419 178.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.421 HG13 HD12 ' A' 3611 ' ' ILE . 4.5 t -120.5 116.01 48.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.234 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -97.57 111.71 23.87 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 169.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.426 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 39.1 mt-30 -94.76 111.29 23.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.067 -177.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.603 HG12 HG12 ' A' 3659 ' ' ILE . 45.2 mt -89.61 98.91 8.63 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.294 178.483 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -88.34 139.5 30.18 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.996 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.547 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 47.5 Cg_endo -68.56 172.95 10.59 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.73 2.287 . . . . 0.0 111.765 178.029 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.03 37.45 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.778 2.318 . . . . 0.0 112.359 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3632 ' ' CYS . . . . . 0.431 ' H ' ' C ' ' A' 3630 ' ' PRO . 24.4 p -77.71 163.47 26.14 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.908 -178.873 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -44.67 -40.94 6.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.288 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3634 ' ' PHE . . . . . 0.443 ' HB2' HD13 ' A' 3560 ' ' LEU . 51.2 t80 -52.67 -51.53 59.83 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 34.4 p -70.08 -54.22 14.03 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.126 -173.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -58.81 -37.66 76.87 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -176.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 15.0 t -62.82 -50.71 69.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.094 0.473 . . . . 0.0 110.341 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 57.6 m80 -67.71 -32.72 73.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.647 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3639 ' ' LEU . . . . . 0.435 ' HB3' HD23 ' A' 3647 ' ' LEU . 79.1 mt -63.94 -39.51 94.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.726 176.327 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3640 ' ' SER . . . . . . . . . . . . . 46.6 m -67.21 -26.76 66.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.265 0.555 . . . . 0.0 110.298 178.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 24.9 ttm180 -80.42 -47.52 14.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.759 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.792 HD13 HD22 ' A' 3575 ' ' LEU . 9.9 mt -86.9 -31.82 20.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.908 -170.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.419 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -150.45 73.24 9.07 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -174.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.24 -16.4 48.37 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.723 2.282 . . . . 0.0 111.958 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3645 ' ' ASP . . . . . 0.598 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 3.9 m-20 -71.92 -55.03 8.22 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.083 -178.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.621 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.5 -30.19 47.03 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.889 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.502 ' HA ' ' CG1' ' A' 3650 ' ' ILE . 3.3 tm? -54.5 -43.2 71.61 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.909 0.385 . . . . 0.0 110.235 177.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3648 ' ' ALA . . . . . 0.441 ' O ' HG21 ' A' 3496 ' ' VAL . . . -63.25 -21.69 66.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.511 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.59 ' HA ' ' CG2' ' A' 3496 ' ' VAL . 14.7 t -90.1 -31.12 17.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.89 0.376 . . . . 0.0 110.728 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.615 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.0 pt -84.72 -11.4 11.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.768 -175.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 10.7 p -62.78 -20.5 65.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.025 0.441 . . . . 0.0 110.521 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -85.51 -38.05 18.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.254 0.549 . . . . 0.0 109.94 173.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.615 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.1 tp -105.22 41.17 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 122.322 1.058 . . . . 0.0 109.446 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.466 ' N ' ' HD2' ' A' 3655 ' ' PRO . 64.5 m -36.71 -44.51 1.17 Allowed Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 114.26 -1.336 . . . . 0.0 113.837 172.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' 3654 ' ' SER . 12.8 Cg_endo -58.73 88.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.491 1.46 . . . . 0.0 111.744 169.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -157.16 177.67 11.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.343 -177.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.44 HD11 HD11 ' A' 3595 ' ' LEU . 36.3 mt -127.96 139.67 52.44 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.81 -178.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 55.6 ttp -102.48 109.27 20.85 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.886 HD12 HD21 ' A' 3524 ' ' LEU . 79.4 mt -101.21 116.29 44.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-O 121.291 0.567 . . . . 0.0 111.25 -173.163 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.747 HG13 ' HD2' ' A' 3573 ' ' TYR . 71.7 t -101.6 115.71 43.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.928 -177.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.625 HG12 ' HG ' ' A' 3626 ' ' LEU . 64.9 mt -90.84 112.7 25.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.374 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -114.31 127.7 55.99 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.898 0.38 . . . . 0.0 111.599 -177.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 53.0 m -84.42 135.12 34.4 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.008 171.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 5.9 p . . . . . 0 C--O 1.249 1.071 0 CA-C-O 119.008 -0.52 . . . . 0.0 109.67 176.155 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.629 ' CD1' ' HB2' ' A' 3553 ' ' MET . 38.3 m-85 . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 111.501 0.186 . . . . 0.0 111.501 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.577 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 4.9 mm-40 52.38 -152.14 0.26 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.551 0.691 . . . . 0.0 110.788 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 76.3 m -153.27 117.19 4.78 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 169.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.655 HD23 ' NH1' ' A' 3552 ' ' ARG . 0.1 OUTLIER -78.95 -129.48 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.746 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.829 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -128.89 -161.39 1.11 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.753 -170.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.416 -178.218 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.459 ' HB ' ' HB3' ' A' 3649 ' ' SER . 35.9 m . . . . . 0 N--CA 1.479 0.985 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 11.9 t70 -105.47 111.08 23.65 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3498 ' ' MET . . . . . 0.568 ' HG2' ' HB3' ' A' 3502 ' ' LEU . 55.5 ttp -82.41 -25.06 34.03 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.377 178.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.48 ' HA ' HD12 ' A' 3502 ' ' LEU . 22.3 t -61.11 -24.93 34.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.025 -173.396 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -80.15 -60.63 2.26 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.745 0.307 . . . . 0.0 110.526 173.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.563 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.1 pp -61.69 -38.63 88.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -174.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.643 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -69.09 -15.99 63.57 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 118.502 0.592 . . . . 0.0 110.872 -172.26 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.646 ' HE2' ' HA ' ' A' 3503 ' ' LYS . 7.7 mmpt? -78.51 -15.61 58.4 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.969 0.414 . . . . 0.0 109.921 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -101.02 -43.69 5.96 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 174.032 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.707 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.7 103.65 3.05 Favored Pre-proline 0 N--CA 1.443 -0.789 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.715 179.786 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -84.0 174.97 7.96 Favored 'Trans proline' 0 CA--C 1.531 0.373 0 C-N-CA 124.381 3.387 . . . . 0.0 113.705 -176.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.439 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 93.0 mt -70.63 139.41 20.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.044 179.241 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 27.4 m -107.17 -26.27 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.357 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.844 ' HD1' HD23 ' A' 3540 ' ' LEU . 61.2 t90 -153.87 145.41 23.21 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -142.42 120.02 11.78 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.98 -128.19 1.01 Allowed Glycine 0 N--CA 1.442 -0.942 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -178.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.624 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.0 mp -139.45 151.84 46.55 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.051 0.453 . . . . 0.0 110.901 179.304 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.47 HD23 ' HB2' ' A' 3547 ' ' LEU . 78.6 mt -105.74 146.03 30.35 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 168.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.661 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -141.47 123.39 15.37 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.755 -176.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.723 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.15 146.49 40.69 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 173.264 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.723 ' CD ' HD12 ' A' 3515 ' ' LEU . 1.1 mptm? 59.17 -92.91 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.179 0.592 . . . . 0.0 110.549 -171.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -142.08 4.98 1.68 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.187 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -103.02 135.73 44.17 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.384 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.523 HG22 ' HB2' ' A' 3514 ' ' ALA . 7.2 p -116.31 132.25 56.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.867 177.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -124.27 112.86 17.51 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.71 176.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.624 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.78 121.32 17.8 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.434 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -132.64 147.79 31.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.733 0.777 . . . . 0.0 111.911 -175.621 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -108.31 124.92 51.07 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.787 173.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.851 HD21 HD12 ' A' 3659 ' ' ILE . 1.4 mt -94.38 108.77 20.67 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.718 -175.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.449 ' CD2' HD11 ' A' 3501 ' ' LEU . 78.4 m80 -85.66 136.93 33.17 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.826 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.707 ' O ' ' HB2' ' A' 3505 ' ' TYR . 68.0 t80 -67.23 137.77 56.43 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.585 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.5 t -114.94 -56.43 4.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.53 0.681 . . . . 0.0 110.565 175.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 57.7 m -163.57 173.06 13.49 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.549 -171.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3529 ' ' GLY . . . . . 0.442 ' HA3' ' HA ' ' A' 3574 ' ' CYS . . . 90.78 -165.0 30.5 Favored Glycine 0 C--O 1.229 -0.2 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.253 177.452 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.569 ' HB2' ' HA ' ' A' 3571 ' ' THR . 49.2 t30 -92.72 108.48 20.02 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.618 0.247 . . . . 0.0 110.539 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 7.8 p30 -61.12 -25.02 66.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.405 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 59.2 t -62.5 -32.87 56.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.947 0.403 . . . . 0.0 110.422 178.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.459 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 24.9 mt -60.52 -39.39 87.62 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.603 177.142 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.475 ' HB1' HD12 ' A' 3538 ' ' LEU . . . -67.69 -40.95 84.32 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-O 120.72 0.295 . . . . 0.0 110.611 -178.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -59.59 -41.63 90.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.856 178.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -89.32 -7.74 54.73 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -174.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.566 ' HB2' HD11 ' A' 3626 ' ' LEU . 66.7 p -104.36 -41.6 5.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.086 0.47 . . . . 0.0 110.876 178.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.71 HD13 ' HB2' ' A' 3509 ' ' TRP . 25.7 mt -80.31 113.64 40.65 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.627 -178.045 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -78.29 134.97 13.14 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.39 2.06 . . . . 0.0 112.415 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.844 HD23 ' HD1' ' A' 3509 ' ' TRP . 2.7 pp -161.59 -177.41 5.9 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.712 -175.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 70.9 m 72.81 -32.85 0.25 Allowed 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.472 0.709 . . . . 0.0 111.803 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3542 ' ' GLU . . . . . 0.404 ' H ' ' C ' ' A' 3540 ' ' LEU . 7.4 pt-20 -109.19 95.03 5.36 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.191 0.52 . . . . 0.0 110.705 177.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 77.07 -45.6 2.29 Favored Glycine 0 CA--C 1.518 0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.978 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 86.46 66.15 1.39 Allowed Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 -175.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.03 141.65 21.22 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.714 2.276 . . . . 0.0 113.152 -173.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.14 134.6 23.45 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.569 2.179 . . . . 0.0 111.613 176.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.688 ' HB3' HD13 ' A' 3612 ' ' ILE . 36.0 mt -68.95 112.11 5.4 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.661 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -95.5 138.61 32.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.033 0.444 . . . . 0.0 110.792 -177.101 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.491 ' HA ' HG12 ' A' 3612 ' ' ILE . 17.9 mt -90.54 107.7 18.77 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 CA-C-O 122.155 0.979 . . . . 0.0 111.145 -174.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.422 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -106.99 -5.78 17.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.722 -1.126 . . . . 0.0 111.913 -172.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.664 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 85.0 mt-30 -150.92 175.65 11.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.654 0.264 . . . . 0.0 111.004 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.751 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -149.92 138.9 21.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.049 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.76 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 22.0 ttt -109.77 107.73 17.83 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.276 175.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 34.6 mtm180 -60.09 110.73 1.28 Allowed 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.804 0.335 . . . . 0.0 110.127 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.526 ' HB2' HD21 ' A' 3560 ' ' LEU . 1.8 pp -76.58 97.33 4.36 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.164 0.983 . . . . 0.0 109.863 -176.271 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.592 ' O ' ' HG ' ' A' 3560 ' ' LEU . 31.4 mt-10 -106.54 168.86 8.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.595 178.078 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.479 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.73 -50.57 68.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.724 0.297 . . . . 0.0 110.62 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 8.2 p -60.94 -40.89 94.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.389 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.583 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 77.8 mm-40 -66.31 -42.69 87.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.103 -177.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' 3556 ' ' GLU . 84.3 mt -60.39 -35.31 75.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.751 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' 3557 ' ' ALA . 15.0 mm-40 -59.89 -46.33 89.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.093 174.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -63.0 -38.76 97.14 Favored Glycine 0 N--CA 1.452 -0.247 0 CA-C-N 115.437 -0.802 . . . . 0.0 112.337 177.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.58 ' O ' ' HG3' ' A' 3567 ' ' MET . 62.1 t -62.02 -54.26 36.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.623 0.249 . . . . 0.0 110.429 177.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -60.87 -29.79 69.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.865 0.364 . . . . 0.0 111.11 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.429 ' O ' HG22 ' A' 3568 ' ' THR . 3.0 tmt_? -59.93 -42.5 94.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.58 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -87.65 -10.34 51.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.197 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.58 ' HG3' ' O ' ' A' 3563 ' ' VAL . 85.9 mtp -85.24 -18.91 32.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.813 0.339 . . . . 0.0 111.413 -179.018 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3568 ' ' THR . . . . . 0.429 HG22 ' O ' ' A' 3565 ' ' ARG . 12.0 t -82.96 -7.35 59.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.03 0.443 . . . . 0.0 110.529 -178.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 55.2 t -117.65 93.83 2.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-O 121.043 0.449 . . . . 0.0 110.202 178.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -74.67 108.11 7.21 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.569 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.8 m 154.59 -41.66 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.482 1.513 . . . . 0.0 107.669 -172.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -87.01 -26.11 23.92 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.179 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.853 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -132.62 163.56 28.63 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.931 177.472 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.618 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 42.1 t -128.29 136.63 51.26 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 170.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.804 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.2 126.11 51.73 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.609 HD11 HD11 ' A' 3661 ' ' ILE . 79.4 mt -127.87 153.85 46.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.904 -177.588 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.757 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -119.56 108.23 14.25 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.415 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.515 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.18 120.71 34.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.39 0.614 . . . . 0.0 110.337 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.564 ' HG ' HD12 ' A' 3577 ' ' LEU . 62.5 mt -123.09 145.32 45.69 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.855 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.62 126.73 22.16 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.377 2.051 . . . . 0.0 112.213 179.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 31.5 p -119.14 116.46 26.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.111 0.481 . . . . 0.0 109.871 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.32 146.05 16.39 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.464 -0.874 . . . . 0.0 112.23 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3583 ' ' ARG . . . . . 0.421 ' HE ' ' CG ' ' A' 3587 ' ' ASP . 36.3 mtm180 -59.64 -46.79 87.94 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.444 0.64 . . . . 0.0 109.771 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.572 ' O ' HG23 ' A' 3588 ' ' VAL . 4.8 m-20 -132.12 177.06 7.85 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.564 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -55.58 -43.0 75.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.931 0.396 . . . . 0.0 110.558 179.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.09 -46.5 90.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.246 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.534 ' O ' ' HG2' ' A' 3591 ' ' GLN . 15.0 t70 -63.47 -40.88 98.3 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.001 -178.26 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' 3584 ' ' ASP . 72.1 t -53.85 -47.18 63.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.774 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 94.2 t -60.62 -46.5 95.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.304 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 46.8 t -62.61 -44.94 95.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.404 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3591 ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' 3587 ' ' ASP . 72.1 mm-40 -64.35 -42.0 96.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.762 0.315 . . . . 0.0 110.287 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3592 ' ' THR . . . . . 0.424 ' O ' ' HG3' ' A' 3596 ' ' LYS . 57.8 m -59.63 -53.45 57.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.861 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' 3596 ' ' LYS . 11.2 pt-20 -65.5 -35.07 79.8 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 121.044 -0.263 . . . . 0.0 111.638 -177.091 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 38.1 m -65.43 -44.17 88.18 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.519 HD12 ' HB2' ' A' 3599 ' ' PHE . 53.3 tp -63.01 -44.76 95.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.476 178.397 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.572 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 58.9 mtpt -56.4 -58.18 9.1 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.67 177.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.44 -33.46 75.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.702 -175.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.597 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.62 -46.44 6.63 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -171.792 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.519 ' HB2' HD12 ' A' 3595 ' ' LEU . 19.8 m-85 -99.71 -50.46 4.04 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.79 0.329 . . . . 0.0 111.339 -173.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.572 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 23.4 mm -62.61 -52.6 57.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.032 -176.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 75.3 m -59.49 -45.25 92.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.037 178.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.718 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -66.6 -56.34 11.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.568 -178.14 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.718 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -55.18 -44.3 75.12 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -175.969 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -73.85 -34.23 64.42 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.685 -176.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.76 -38.4 80.07 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.207 0.527 . . . . 0.0 110.646 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -77.69 -18.64 56.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.445 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 50.72 53.74 12.45 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.484 -169.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.584 ' O ' HD12 ' A' 3603 ' ' LEU . . . -136.26 -175.53 4.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.734 -172.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.76 ' HB3' ' HB3' ' A' 3553 ' ' MET . . . -120.47 121.33 38.24 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.678 177.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3610 ' ' GLY . . . . . 0.521 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.92 101.53 0.49 Allowed Glycine 0 C--O 1.222 -0.654 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.142 177.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.664 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 29.3 mm -89.97 125.58 42.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.192 0.52 . . . . 0.0 110.928 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.688 HD13 ' HB3' ' A' 3547 ' ' LEU . 41.1 mt -124.63 117.32 50.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.714 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -83.34 141.81 31.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.285 -175.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.527 HG11 ' HA ' ' A' 3537 ' ' SER . 58.8 t -136.85 125.72 15.2 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.458 178.146 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.527 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 71.7 Cg_endo -92.39 145.37 2.73 Favored 'Trans proline' 0 N--CA 1.45 -1.077 0 C-N-CA 122.67 2.247 . . . . 0.0 112.362 173.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.537 ' HB2' ' HB3' ' A' 3620 ' ' ASN . 0.9 OUTLIER -117.62 75.89 9.85 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 172.605 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.31 118.71 4.58 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.482 2.788 . . . . 0.0 113.336 -170.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 104.25 -44.1 1.54 Allowed Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.49 176.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 17.2 m -98.66 -31.58 11.85 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.811 0.338 . . . . 0.0 111.334 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3620 ' ' ASN . . . . . 0.537 ' HB3' ' HB2' ' A' 3616 ' ' ASN . 9.9 t-20 -150.6 -174.79 4.87 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -178.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.857 ' HB3' ' HD2' ' A' 3622 ' ' PRO . 79.4 mt-30 -106.44 -178.86 0.64 Allowed Pre-proline 0 C--N 1.318 -0.789 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.857 ' HD2' ' HB3' ' A' 3621 ' ' GLN . 41.1 Cg_endo -68.51 25.18 0.14 Allowed 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.969 2.446 . . . . 0.0 112.281 170.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3623 ' ' ALA . . . . . 0.515 ' H ' ' C ' ' A' 3621 ' ' GLN . . . -80.14 12.33 2.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.682 -173.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.516 ' HB2' ' O ' ' A' 3614 ' ' VAL . 68.0 m-85 -89.5 132.55 34.99 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-O 121.441 0.639 . . . . 0.0 109.6 177.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.564 HG12 ' HG3' ' A' 3627 ' ' GLN . 6.1 t -131.67 113.18 22.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.016 -176.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.659 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -92.31 111.52 23.12 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 171.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.564 ' HG3' HG12 ' A' 3625 ' ' VAL . 50.2 mt-30 -94.33 110.28 22.05 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.757 -177.533 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.606 HG12 HG12 ' A' 3659 ' ' ILE . 46.8 mt -93.72 97.66 7.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.184 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -87.92 143.64 33.6 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.905 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.466 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 42.9 Cg_endo -67.58 171.07 12.49 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.554 2.169 . . . . 0.0 111.396 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.52 41.66 0.53 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 122.844 2.363 . . . . 0.0 112.816 178.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 15.4 p -75.7 161.7 28.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.919 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3633 ' ' GLU . . . . . 0.427 ' OE2' ' HB2' ' A' 3637 ' ' SER . 4.4 tm-20 -48.85 -44.23 39.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.763 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 21.3 t80 -49.38 -49.85 42.85 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.477 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.5 m -63.56 -54.96 27.89 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.962 -177.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3636 ' ' GLU . . . . . 0.432 ' HA ' HD12 ' A' 3639 ' ' LEU . 3.7 mm-40 -62.5 -34.25 76.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.993 -175.399 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3637 ' ' SER . . . . . 0.427 ' HB2' ' OE2' ' A' 3633 ' ' GLU . 34.2 t -61.22 -50.52 72.76 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.701 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3638 ' ' HIS . . . . . 0.408 ' HB3' HD12 ' A' 3642 ' ' LEU . 38.9 m-70 -65.28 -35.46 81.08 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.066 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3639 ' ' LEU . . . . . 0.446 HD13 HD12 ' A' 3650 ' ' ILE . 88.5 mt -63.89 -39.2 93.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.977 177.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3640 ' ' SER . . . . . 1.034 ' HA ' HD22 ' A' 3647 ' ' LEU . 33.6 t -59.72 -37.52 79.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.173 0.511 . . . . 0.0 110.718 177.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 31.6 mtp180 -83.88 -37.66 22.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.28 -179.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.804 HD13 HD22 ' A' 3575 ' ' LEU . 23.5 mt -87.69 -31.13 19.88 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -172.273 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.439 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -154.66 87.34 3.43 Favored Pre-proline 0 N--CA 1.465 0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 111.659 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -74.76 -21.75 16.12 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 122.577 2.185 . . . . 0.0 113.783 -175.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.25 -53.09 10.48 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.394 -0.523 . . . . 0.0 109.842 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.757 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -71.06 -26.44 63.08 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.858 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A 3647 ' ' LEU . . . . . 1.034 HD22 ' HA ' ' A' 3640 ' ' SER . 25.2 tp -53.27 -49.69 66.4 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.353 175.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -58.1 -27.2 63.48 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.016 0.436 . . . . 0.0 110.846 -178.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.459 ' HB3' ' HB ' ' A' 3496 ' ' VAL . 13.6 m -77.85 -45.15 25.14 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.243 178.02 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.626 ' HA ' HG22 ' A' 3653 ' ' ILE . 3.8 pt -73.87 -20.13 17.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.82 0.343 . . . . 0.0 111.566 -175.055 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.5 m -58.09 -28.21 64.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.968 0.413 . . . . 0.0 110.309 175.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -88.51 -34.5 17.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.737 175.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.626 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.3 tp -104.99 42.68 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 122.662 1.22 . . . . 0.0 109.014 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.492 ' N ' ' HD2' ' A' 3655 ' ' PRO . 5.4 p -40.1 -38.0 0.95 Allowed Pre-proline 0 CA--C 1.54 0.587 0 CA-C-N 113.61 -1.632 . . . . 0.0 114.216 172.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' 3654 ' ' SER . 19.4 Cg_endo -62.95 78.57 0.11 Allowed 'Trans proline' 0 C--N 1.359 1.113 0 CA-C-N 120.832 1.333 . . . . 0.0 111.415 169.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3656 ' ' HIS . . . . . 0.469 ' HB2' HD23 ' A' 3579 ' ' LEU . 20.5 p80 -148.19 176.17 10.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.061 -177.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.486 HD22 HG22 ' A' 3628 ' ' ILE . 28.0 mt -122.49 152.34 40.41 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.204 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 13.4 tmm? -115.34 113.24 23.54 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 175.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.851 HD12 HD21 ' A' 3524 ' ' LEU . 80.9 mt -107.55 123.2 62.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.35 0.595 . . . . 0.0 111.971 -170.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.853 HG13 ' HD2' ' A' 3573 ' ' TYR . 78.9 t -108.25 112.7 41.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.644 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.659 HG12 ' HG ' ' A' 3626 ' ' LEU . 58.1 mt -90.57 112.33 24.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.679 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -128.35 143.46 51.01 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.437 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 14.6 m -94.42 107.97 19.91 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 42.8 t . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.455 -0.783 . . . . 0.0 110.193 -178.311 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.531 ' CD1' ' HB2' ' A' 3553 ' ' MET . 64.7 m-85 . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 119.677 -0.201 . . . . 0.0 111.403 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.621 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.8 OUTLIER 56.93 -160.9 0.22 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.526 0.679 . . . . 0.0 111.391 179.233 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.417 ' H ' ' HB3' ' B' 2519 ' ' GLU . 19.2 m -146.53 115.9 7.07 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 166.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.63 ' HG ' ' N ' ' B' 2522 ' ' SEP . 20.3 tp -78.06 -126.76 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.817 -176.444 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.708 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 26.0 t70 -166.69 -75.43 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.579 174.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 . . . . . 0 C--O 1.252 1.208 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 -177.76 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 3496 ' ' VAL . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.798 0.333 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 17.0 t70 -104.95 113.73 27.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.876 0.369 . . . . 0.0 110.557 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 50.8 mtm -81.63 -21.44 38.24 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.676 -178.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.474 ' HA ' HD12 ' A' 3502 ' ' LEU . 22.7 t -63.46 -24.92 37.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.42 -174.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3500 ' ' GLN . . . . . 0.441 ' OE1' ' HA ' ' A' 3500 ' ' GLN . 14.7 mm-40 -77.17 -55.76 5.15 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.013 0.435 . . . . 0.0 110.859 174.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.578 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp -70.06 -32.99 71.36 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -171.295 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.603 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.27 -15.55 62.92 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.818 -175.91 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.603 ' N ' HD13 ' A' 3502 ' ' LEU . 18.9 ttpp -65.21 -25.14 67.57 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.563 176.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -105.57 -42.14 5.28 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.745 175.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.671 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.27 108.75 3.19 Favored Pre-proline 0 CA--C 1.536 0.411 0 CA-C-O 121.38 0.609 . . . . 0.0 111.445 -178.624 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -85.49 174.54 6.79 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 124.221 3.281 . . . . 0.0 113.798 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.517 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.6 mt -72.14 134.46 29.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.03 -179.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.444 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.5 m -101.25 -31.92 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.504 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.638 ' CB ' HD13 ' A' 3538 ' ' LEU . 34.8 t-105 -149.08 152.53 36.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.745 0.307 . . . . 0.0 110.566 -177.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -145.51 118.18 8.62 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 175.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.75 -134.51 1.72 Allowed Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.61 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -139.76 151.35 45.73 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.296 0.569 . . . . 0.0 111.532 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.478 HD23 ' HB2' ' A' 3547 ' ' LEU . 73.9 mt -105.45 151.97 23.58 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 170.532 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.677 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.91 125.15 12.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.644 0.259 . . . . 0.0 111.572 -178.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.753 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.97 142.9 40.48 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 173.966 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.753 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 57.47 -93.39 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.496 0.497 . . . . 0.0 109.755 -169.838 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -140.65 7.33 2.1 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.42 ' HB3' ' HB1' ' A' 3598 ' ' ALA . 7.3 m-20 -95.09 144.14 25.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.059 -174.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 17.8 p -132.28 144.12 50.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.963 0.411 . . . . 0.0 111.472 -177.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -139.63 113.82 8.94 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.774 175.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.61 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.29 112.82 9.7 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 26.9 m -125.06 147.78 29.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.623 0.725 . . . . 0.0 112.237 -173.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -106.03 132.72 51.78 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.604 -1.18 . . . . 0.0 108.577 172.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.855 HD21 HD12 ' A' 3659 ' ' ILE . 1.1 mt -104.66 109.11 20.91 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.437 0.637 . . . . 0.0 111.738 -175.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.517 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 76.3 m-70 -84.42 138.44 32.83 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.106 -0.952 . . . . 0.0 108.638 175.485 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.671 ' O ' ' HB2' ' A' 3505 ' ' TYR . 61.5 t80 -68.05 137.46 55.05 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 174.334 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.552 ' CG1' HD23 ' A' 3575 ' ' LEU . 19.8 t -114.8 -56.76 4.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.281 0.562 . . . . 0.0 111.1 177.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 22.7 t -160.57 171.5 18.84 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.422 -173.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.45 -148.02 20.36 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.719 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.592 ' HB2' ' HA ' ' A' 3571 ' ' THR . 38.1 t30 -108.63 116.77 32.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.744 0.307 . . . . 0.0 110.975 -178.341 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -68.67 -23.53 64.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.167 -176.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3532 ' ' VAL . . . . . 0.451 ' O ' ' HG2' ' A' 3536 ' ' ARG . 90.0 t -59.71 -36.29 64.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.876 0.37 . . . . 0.0 110.313 177.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.51 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 59.1 mt -59.33 -37.42 77.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.874 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.43 ' HB1' ' CD1' ' A' 3538 ' ' LEU . . . -69.47 -41.4 76.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.619 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 15.6 t60 -60.39 -36.26 77.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.151 -177.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' 3532 ' ' VAL . 12.5 ptp180 -89.13 -26.66 21.21 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.2 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.626 ' O ' HG11 ' A' 3614 ' ' VAL . 72.8 p -86.72 -38.94 16.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.119 0.485 . . . . 0.0 110.904 -178.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.638 HD13 ' CB ' ' A' 3509 ' ' TRP . 22.0 mt -81.51 123.57 80.83 Favored Pre-proline 0 C--N 1.316 -0.855 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3539 ' ' PRO . . . . . 0.91 ' HB2' ' HD2' ' A' 3545 ' ' PRO . 6.2 Cg_endo -72.44 120.08 6.52 Favored 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 121.801 1.667 . . . . 0.0 111.383 -178.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.514 ' HB3' ' CZ3' ' A' 3509 ' ' TRP . 1.6 pp -156.45 -178.21 7.16 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.34 -172.798 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 70.5 m 71.1 -0.23 3.15 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.554 0.742 . . . . 0.0 112.455 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -172.84 97.73 0.13 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.384 0.612 . . . . 0.0 110.782 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 83.98 -60.96 4.8 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.409 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 72.41 67.71 1.77 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 121.177 -0.535 . . . . 0.0 112.164 -178.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.91 ' HD2' ' HB2' ' A' 3539 ' ' PRO . 17.5 Cg_exo -65.99 154.8 72.54 Favored 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.809 2.339 . . . . 0.0 112.395 -178.477 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.58 145.83 77.51 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.499 2.132 . . . . 0.0 112.186 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.689 ' HB3' HD13 ' A' 3612 ' ' ILE . 49.9 mt -81.82 112.74 19.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.261 177.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.677 ' HA ' ' O ' ' A' 3514 ' ' ALA . 21.7 ptt85 -90.34 141.51 28.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.871 0.367 . . . . 0.0 111.196 -177.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.522 HG22 HD12 ' B' 2521 ' ' LEU . 20.2 mt -95.02 107.14 19.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.865 0.841 . . . . 0.0 110.636 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.476 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -110.83 -4.15 15.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.594 -172.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.66 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 52.9 mt-30 -150.97 176.49 11.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.955 -0.111 . . . . 0.0 111.022 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.768 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -160.38 140.13 11.13 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -177.78 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.579 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -112.4 125.21 53.96 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.72 -0.218 . . . . 0.0 110.641 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3554 ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' 3554 ' ' ARG . 13.6 mmt85 -68.82 110.3 4.29 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.597 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -72.35 98.57 2.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 122.293 1.045 . . . . 0.0 110.318 -175.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.58 ' O ' ' HG ' ' A' 3560 ' ' LEU . 37.8 mt-10 -106.24 156.88 18.02 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.492 177.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.503 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -53.96 -50.24 66.95 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.125 0.266 . . . . 0.0 111.295 -177.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 18.7 p -63.98 -42.54 97.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.905 0.383 . . . . 0.0 111.246 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.505 ' O ' HG23 ' A' 3563 ' ' VAL . 80.9 mm-40 -61.37 -42.46 98.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.078 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.58 HD21 ' HB2' ' A' 3555 ' ' LEU . 94.0 mt -65.18 -31.9 73.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.199 -178.054 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' 3557 ' ' ALA . 22.4 mm-40 -66.78 -45.27 79.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.214 0.53 . . . . 0.0 109.636 175.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -57.66 -41.75 93.89 Favored Glycine 0 CA--C 1.519 0.291 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.036 174.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.581 ' O ' ' HG3' ' A' 3567 ' ' MET . 97.1 t -61.94 -46.75 95.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.843 0.354 . . . . 0.0 110.207 177.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -62.61 -25.48 68.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.541 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.464 ' O ' HG22 ' A' 3568 ' ' THR . 41.5 ttm105 -63.61 -34.58 78.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.64 178.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3566 ' ' ARG . . . . . 0.549 ' HG2' ' O ' ' A' 3563 ' ' VAL . 10.5 ptp180 -86.45 -18.97 30.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.19 0.519 . . . . 0.0 109.889 176.774 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.581 ' HG3' ' O ' ' A' 3563 ' ' VAL . 90.0 mtp -75.44 -22.29 57.47 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.917 -177.218 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3568 ' ' THR . . . . . 0.464 HG22 ' O ' ' A' 3565 ' ' ARG . 6.1 t -80.22 -8.65 59.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.126 0.489 . . . . 0.0 110.25 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.4 t -113.16 89.65 1.34 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.354 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.91 110.45 6.42 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.072 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.592 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 3.3 m 147.48 -39.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.894 1.677 . . . . 0.0 107.819 -177.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.02 -30.79 44.4 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.665 -179.261 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.806 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -133.43 167.14 20.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.068 178.464 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.637 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 35.2 t -128.11 137.06 51.97 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 172.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.763 HD22 HD13 ' A' 3642 ' ' LEU . 14.1 tp -106.43 125.52 51.1 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.622 HD11 HD11 ' A' 3661 ' ' ILE . 80.3 mt -128.23 155.22 44.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.177 0.513 . . . . 0.0 110.899 -177.405 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.729 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -122.12 108.53 13.45 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.407 179.367 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.465 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -95.0 125.91 39.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.289 0.566 . . . . 0.0 110.706 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.51 HD23 ' HB2' ' A' 3656 ' ' HIS . 75.3 mt -125.24 144.44 47.48 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.242 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -61.87 112.22 1.44 Allowed 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.347 2.031 . . . . 0.0 111.874 178.137 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 26.4 p -104.7 120.61 41.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.868 0.366 . . . . 0.0 110.345 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3582 ' ' GLY . . . . . 0.4 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.07 145.17 16.19 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.849 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -67.13 -38.55 85.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.743 0.782 . . . . 0.0 109.465 176.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.598 ' O ' HG23 ' A' 3588 ' ' VAL . 29.1 t70 -136.73 169.68 17.34 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.524 -1.216 . . . . 0.0 107.808 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -56.65 -37.1 70.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.287 0.494 . . . . 0.0 110.512 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -60.72 -46.55 89.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.285 0.564 . . . . 0.0 109.509 176.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.439 ' HB3' ' H ' ' A' 3584 ' ' ASP . 23.4 t70 -64.37 -42.54 96.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.785 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' 3584 ' ' ASP . 89.6 t -54.76 -47.49 74.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.776 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 87.8 t -58.95 -49.44 83.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.385 178.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 23.0 t -60.07 -48.91 79.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.765 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -63.37 -37.83 88.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.859 -0.155 . . . . 0.0 111.413 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 66.5 m -61.51 -52.0 66.28 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.068 0.461 . . . . 0.0 110.484 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.521 ' HA ' ' HG2' ' A' 3596 ' ' LYS . 26.9 mt-10 -68.55 -38.66 80.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.886 -179.293 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 18.3 t -58.03 -49.65 76.14 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.136 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.572 HD12 ' HB2' ' A' 3599 ' ' PHE . 57.8 tp -62.5 -46.69 87.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.327 -178.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.818 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 65.7 pttt -70.35 -33.85 71.95 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.143 -175.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -77.82 -37.34 48.84 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 121.041 -0.264 . . . . 0.0 111.709 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.42 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -91.96 -46.95 7.55 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -172.082 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.572 ' HB2' HD12 ' A' 3595 ' ' LEU . 14.8 m-85 -98.7 -49.74 4.49 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.637 0.256 . . . . 0.0 111.294 -174.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.818 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 25.1 mm -60.55 -55.31 25.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.708 -178.367 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 64.2 m -57.63 -38.46 75.03 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.208 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.744 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -68.84 -57.11 6.02 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.866 178.522 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.744 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.22 -41.91 76.4 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.569 0.223 . . . . 0.0 111.55 -177.212 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -72.05 -36.93 69.76 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.703 -177.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.33 -36.95 80.04 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.053 0.454 . . . . 0.0 110.758 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -79.61 -18.31 51.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.87 178.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3607 ' ' GLN . . . . . 0.537 ' O ' ' HG ' ' A' 3555 ' ' LEU . 72.7 mt-30 51.92 48.31 23.02 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -171.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.574 ' O ' HD12 ' A' 3603 ' ' LEU . . . -130.24 -175.93 3.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.295 -171.345 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.768 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.71 117.73 28.24 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.499 175.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3610 ' ' GLY . . . . . 0.439 ' N ' HD11 ' A' 3603 ' ' LEU . . . -66.21 105.4 1.27 Allowed Glycine 0 C--O 1.222 -0.641 0 C-N-CA 120.837 -0.696 . . . . 0.0 111.896 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.66 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 35.4 mm -89.69 125.91 42.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.223 0.535 . . . . 0.0 111.22 -175.318 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.689 HD13 ' HB3' ' A' 3547 ' ' LEU . 28.1 mt -121.23 114.72 44.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.302 178.001 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.533 ' HA ' ' O ' ' A' 3624 ' ' TYR . 91.5 m-20 -88.74 127.96 35.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.359 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.626 HG11 ' O ' ' A' 3537 ' ' SER . 4.8 t -126.37 135.32 27.02 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.187 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 79.6 Cg_endo -84.39 136.96 6.78 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 122.103 1.869 . . . . 0.0 111.687 168.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.764 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 26.1 t-20 -66.97 126.91 93.22 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.378 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3617 ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' 3616 ' ' ASN . 32.0 Cg_exo -58.62 102.97 0.15 Allowed 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.974 2.449 . . . . 0.0 112.419 -178.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 109.34 -29.28 9.74 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.882 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3619 ' ' SER . . . . . 0.674 ' HB3' ' HB3' ' A' 3616 ' ' ASN . 29.5 t -94.97 -30.02 14.34 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.928 0.394 . . . . 0.0 110.135 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 63.2 t30 69.68 7.0 6.0 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.304 178.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.428 ' O ' ' HA ' ' A' 3615 ' ' PRO . 88.2 mt-30 -78.73 115.1 49.27 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.41 177.579 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.535 ' HA ' ' O ' ' A' 3614 ' ' VAL . 71.7 Cg_endo -87.85 23.97 0.75 Allowed 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 123.355 2.704 . . . . 0.0 112.618 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -78.95 44.04 0.54 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.363 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.764 ' HE2' ' HB2' ' A' 3616 ' ' ASN . 72.7 m-85 -123.86 133.56 53.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.044 0.449 . . . . 0.0 110.506 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.406 HG13 HG23 ' A' 3611 ' ' ILE . 4.3 t -126.67 114.07 36.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.851 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.619 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -98.42 114.88 27.4 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 169.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.515 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 65.4 mt-30 -94.5 110.92 22.68 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.605 HG12 HG12 ' A' 3659 ' ' ILE . 39.2 mt -92.38 98.7 8.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.279 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -88.55 142.59 31.2 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.917 177.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.507 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 48.2 Cg_endo -68.98 172.96 10.96 Favored 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 122.578 2.185 . . . . 0.0 111.308 176.103 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3631 ' ' PRO . . . . . 0.401 ' HD3' HD12 ' A' 3600 ' ' ILE . 56.4 Cg_endo -70.35 45.23 0.51 Allowed 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.078 2.519 . . . . 0.0 112.276 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.7 p -84.39 163.35 19.57 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.982 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -42.62 -49.85 5.47 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 123.959 0.787 . . . . 0.0 112.02 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3634 ' ' PHE . . . . . 0.506 ' HB2' HD13 ' A' 3560 ' ' LEU . 38.6 t80 -50.82 -48.12 59.82 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 123.339 0.399 . . . . 0.0 111.487 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.7 m -68.15 -58.43 4.47 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.629 -176.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -60.93 -41.15 95.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.427 -173.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 9.0 t -66.19 -44.97 82.42 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 120.927 0.394 . . . . 0.0 110.243 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 19.7 m80 -68.87 -30.13 68.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.629 178.726 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 68.9 mt -66.01 -40.66 91.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.846 175.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.475 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 32.7 t -67.1 -25.55 66.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.15 0.5 . . . . 0.0 110.181 177.47 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -83.86 -38.6 20.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.189 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.763 HD13 HD22 ' A' 3575 ' ' LEU . 12.7 mt -94.91 -31.4 13.69 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -172.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -149.08 75.27 9.82 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -175.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -67.91 -18.75 46.77 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.788 2.325 . . . . 0.0 111.782 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3645 ' ' ASP . . . . . 0.531 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 2.7 m-20 -71.11 -49.95 38.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.196 -177.166 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.729 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -83.05 -29.11 29.1 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.444 178.818 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.475 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.35 -43.83 71.64 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.97 0.414 . . . . 0.0 110.45 179.255 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -67.14 -18.46 65.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.233 -0.44 . . . . 0.0 112.098 -176.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 89.1 p -91.49 -26.19 18.92 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.227 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.627 ' HA ' HG22 ' A' 3653 ' ' ILE . 7.1 pt -88.07 -10.44 10.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.558 -177.03 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.2 p -58.58 -23.93 59.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.875 175.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 5.3 t30 -85.9 -36.51 19.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.094 0.473 . . . . 0.0 110.206 175.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.627 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.4 tp -104.47 38.95 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 122.379 1.085 . . . . 0.0 109.789 -178.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.442 ' N ' ' HD2' ' A' 3655 ' ' PRO . 50.7 m -36.78 -42.24 0.81 Allowed Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 114.157 -1.383 . . . . 0.0 113.947 170.527 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.451 ' HG2' HD12 ' A' 3653 ' ' ILE . 12.9 Cg_endo -59.75 77.44 0.06 OUTLIER 'Trans proline' 0 C--N 1.357 1.008 0 C-N-CA 121.533 1.489 . . . . 0.0 111.517 168.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3656 ' ' HIS . . . . . 0.51 ' HB2' HD23 ' A' 3579 ' ' LEU . 22.5 p80 -147.69 174.89 11.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.776 -177.165 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.479 HD22 HG22 ' A' 3628 ' ' ILE . 42.9 mt -120.76 149.85 41.91 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.525 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 16.2 tmm? -113.98 114.54 26.31 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.855 HD12 HD21 ' A' 3524 ' ' LEU . 74.8 mt -108.38 121.22 61.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.169 0.509 . . . . 0.0 111.811 -170.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.806 HG13 ' HD2' ' A' 3573 ' ' TYR . 76.1 t -105.34 114.77 45.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.918 -178.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.637 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 57.5 mt -91.15 118.45 36.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.314 178.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.5 127.66 55.77 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.654 0.264 . . . . 0.0 110.615 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A 3663 ' ' SER . . . . . 0.421 ' HB2' HD22 ' A' 3533 ' ' LEU . 33.6 t -91.73 122.35 34.2 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.41 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 C--O 1.251 1.154 0 CA-C-O 117.337 -1.316 . . . . 0.0 112.693 178.221 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.579 ' CD1' ' HB2' ' A' 3553 ' ' MET . 8.9 m-85 . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 111.619 0.229 . . . . 0.0 111.619 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.613 ' O ' ' HG2' ' A' 3551 ' ' GLN . 4.5 tt0 58.44 -155.81 0.34 Allowed 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.571 ' H ' ' CG ' ' B' 2519 ' ' GLU . 58.5 m -155.07 121.87 5.42 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 175.248 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.588 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER -84.53 -130.12 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.252 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.66 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -162.4 -156.28 0.4 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 44.1 tt0 . . . . . 0 C--O 1.247 0.941 0 CA-C-O 118.803 -0.617 . . . . 0.0 110.463 -179.953 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.407 HG11 ' HB1' ' A' 3648 ' ' ALA . 7.3 m . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 121.811 0.815 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3497 ' ' ASP . . . . . 0.405 ' OD1' HG23 ' A' 3499 ' ' VAL . 10.8 t70 -87.38 154.57 20.56 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.062 -178.161 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3498 ' ' MET . . . . . 0.526 ' O ' HD12 ' A' 3502 ' ' LEU . 38.2 ttp -62.3 -26.53 68.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.788 -0.187 . . . . 0.0 110.772 -179.154 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.466 ' HA ' HD12 ' A' 3502 ' ' LEU . 97.8 t -56.24 -25.0 19.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 121.183 0.516 . . . . 0.0 110.815 177.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -79.6 -58.76 3.03 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.264 174.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.584 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp -66.55 -36.93 83.87 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -172.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.655 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -69.4 -15.32 63.27 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.131 0.491 . . . . 0.0 110.163 -172.582 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.655 ' N ' HD13 ' A' 3502 ' ' LEU . 21.6 tptm -77.9 -25.92 48.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.491 ' HG3' ' OD2' ' A' 3645 ' ' ASP . 31.5 mmtp -89.44 -43.14 11.07 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.706 175.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.733 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -153.74 104.17 2.51 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.18 179.598 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -84.01 174.12 8.58 Favored 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 124.085 3.19 . . . . 0.0 114.091 -174.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.511 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.8 mt -71.39 135.69 27.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.115 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.414 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.7 m -104.75 -29.57 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.292 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.717 ' HE3' HD12 ' A' 3524 ' ' LEU . 45.4 t90 -150.02 155.36 39.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -150.9 127.12 10.57 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . 177.93 -125.81 1.03 Allowed Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.539 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.668 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.3 mp -141.01 158.54 43.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.089 0.471 . . . . 0.0 111.098 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.51 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 79.7 mt -112.05 152.55 28.07 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 169.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.62 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.85 123.31 12.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.802 0.334 . . . . 0.0 111.836 -177.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.782 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.42 142.12 39.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 172.957 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.782 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 60.4 -91.6 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 122.788 0.435 . . . . 0.0 110.034 -171.385 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 45.7 m-80 -142.98 7.04 1.6 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.16 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -99.73 138.04 37.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.714 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.515 HG22 ' HB2' ' A' 3514 ' ' ALA . 15.3 p -128.86 127.82 42.63 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.748 -177.237 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -119.96 120.88 37.64 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.745 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.638 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -75.48 117.05 16.86 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.414 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 30.2 m -129.95 148.36 33.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.417 0.627 . . . . 0.0 111.974 -174.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -110.29 128.71 55.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.259 -0.882 . . . . 0.0 108.872 172.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.866 HD21 HD12 ' A' 3659 ' ' ILE . 1.5 mt -95.6 113.02 24.62 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.186 -174.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.527 ' CE1' HD12 ' A' 3579 ' ' LEU . 70.2 m80 -88.45 141.79 28.25 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.785 175.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.733 ' O ' ' HB2' ' A' 3505 ' ' TYR . 64.3 t80 -71.77 139.71 49.15 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 172.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.582 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.4 t -115.23 -57.59 3.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.461 0.648 . . . . 0.0 110.719 176.081 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.521 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 68.9 m -159.42 171.77 19.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.175 -171.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.57 -149.06 20.33 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.792 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.482 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.4 t-20 -104.64 110.55 22.91 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.211 0.204 . . . . 0.0 110.664 -177.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.9 p30 -63.17 -30.93 71.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.538 -176.555 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 19.1 t -59.92 -33.47 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.88 0.372 . . . . 0.0 110.028 -179.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' A' 3530 ' ' ASN . 17.8 mt -56.71 -48.33 77.96 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.235 175.351 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.445 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.13 -38.23 89.95 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.413 0.625 . . . . 0.0 110.23 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -62.52 -40.21 96.03 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.27 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' 3536 ' ' ARG . 11.4 ptt180 -89.38 -10.01 48.19 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -179.397 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.427 ' HB2' HD11 ' A' 3626 ' ' LEU . 29.8 p -98.9 -41.82 7.43 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 122.015 -0.428 . . . . 0.0 111.506 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.683 HD13 ' HB2' ' A' 3509 ' ' TRP . 29.8 mt -78.84 111.27 18.4 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-O 121.142 0.496 . . . . 0.0 110.063 -173.533 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.21 152.54 45.14 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.078 2.519 . . . . 0.0 112.474 -172.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.502 ' O ' HD12 ' A' 3540 ' ' LEU . 2.2 pp -169.54 138.6 1.95 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.728 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 31.8 t -140.51 -44.32 0.4 Allowed 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -136.96 95.99 3.22 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.807 177.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 78.25 -105.28 2.14 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.924 -175.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -155.73 103.33 0.23 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.089 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.417 ' CD ' ' HA ' ' A' 3540 ' ' LEU . 47.4 Cg_endo -68.88 138.37 40.5 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.843 2.362 . . . . 0.0 112.1 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.668 ' HA ' ' O ' ' A' 3512 ' ' LEU . 33.8 Cg_endo -64.27 121.71 9.43 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.414 2.076 . . . . 0.0 112.52 -177.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.662 ' HB3' HD13 ' A' 3612 ' ' ILE . 24.4 mt -69.05 115.42 8.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.795 174.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.638 ' HD2' ' OD2' ' B' 2523 ' ' ASP . 20.0 ptt180 -90.31 138.64 31.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.06 -176.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.47 ' O ' ' HB3' ' B' 2521 ' ' LEU . 20.8 mt -95.26 106.96 18.87 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 CA-C-O 122.152 0.977 . . . . 0.0 110.865 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.509 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.38 -2.05 14.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.581 -1.191 . . . . 0.0 111.695 -173.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.699 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 66.3 mt-30 -151.13 174.44 13.21 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.459 0.171 . . . . 0.0 111.331 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.75 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -157.0 136.43 12.15 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.357 -177.874 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.574 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 11.7 tmm? -110.03 121.11 44.48 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.288 177.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3554 ' ' ARG . . . . . 0.436 HH11 ' HD2' ' A' 3554 ' ' ARG . 9.3 mmt180 -63.3 111.35 2.23 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.542 ' HB2' HD21 ' A' 3560 ' ' LEU . 2.9 pp -71.84 97.32 1.79 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 122.472 1.13 . . . . 0.0 108.683 178.675 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.484 ' H ' ' HB2' ' A' 3559 ' ' GLN . 6.0 mm-40 -103.9 163.86 12.08 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.498 -177.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -58.45 -45.89 87.66 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.224 0.328 . . . . 0.0 110.18 176.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 44.8 p -66.07 -41.86 90.17 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.107 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.583 ' O ' HG23 ' A' 3563 ' ' VAL . 88.3 mm-40 -63.45 -49.71 72.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.13 -179.164 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.542 HD21 ' HB2' ' A' 3555 ' ' LEU . 79.7 mt -59.69 -37.51 79.02 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.512 -176.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' 3557 ' ' ALA . 7.4 mm-40 -56.58 -53.35 58.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.961 0.41 . . . . 0.0 110.06 175.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -60.89 -41.11 99.15 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.199 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' 3559 ' ' GLN . 91.9 t -60.52 -52.78 57.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.448 0.166 . . . . 0.0 110.635 178.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.5 91.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.787 0.327 . . . . 0.0 111.293 -178.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.541 ' O ' HG22 ' A' 3568 ' ' THR . 98.1 mtt180 -68.05 -27.26 66.37 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.595 -177.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -88.42 -20.08 25.71 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.229 -0.588 . . . . 0.0 110.503 172.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.429 ' HG3' ' O ' ' A' 3563 ' ' VAL . 76.8 mtp -74.69 -21.5 59.36 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.739 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3568 ' ' THR . . . . . 0.541 HG22 ' O ' ' A' 3565 ' ' ARG . 5.6 t -74.88 -7.32 53.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.113 0.483 . . . . 0.0 110.253 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.7 t -105.34 87.93 1.13 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.556 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.149 177.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -73.53 108.16 6.22 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.482 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.4 m 155.04 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.536 1.535 . . . . 0.0 107.811 -174.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -84.69 -24.96 28.73 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.934 -178.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.688 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -130.16 161.52 30.93 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.053 179.616 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.634 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 47.8 t -124.84 135.83 53.26 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 171.279 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.764 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.61 125.55 51.11 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.628 HD11 HD11 ' A' 3661 ' ' ILE . 76.8 mt -125.57 153.44 43.69 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.143 0.497 . . . . 0.0 110.951 -177.306 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.598 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -121.94 106.39 11.19 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.501 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.44 123.99 38.19 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.365 0.602 . . . . 0.0 110.24 -177.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.527 HD12 ' CE1' ' A' 3525 ' ' HIS . 79.1 mt -125.48 143.33 44.41 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.162 -178.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -61.36 113.33 1.73 Allowed 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.406 2.07 . . . . 0.0 111.637 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 28.0 p -100.89 111.69 23.96 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.096 0.474 . . . . 0.0 110.431 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3582 ' ' GLY . . . . . 0.461 ' H ' HG22 ' A' 3588 ' ' VAL . . . -104.07 146.08 16.23 Favored Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.727 177.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3583 ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' 3583 ' ' ARG . 29.4 ttt180 -60.61 -35.82 77.07 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-O 121.344 0.592 . . . . 0.0 110.92 178.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.585 ' O ' HG23 ' A' 3588 ' ' VAL . 28.1 t70 -140.44 169.54 17.47 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -53.59 -39.85 65.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 118.003 0.365 . . . . 0.0 111.181 -178.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -63.39 -44.6 94.24 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.202 0.525 . . . . 0.0 110.603 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.451 ' HB3' ' H ' ' A' 3584 ' ' ASP . 12.6 t70 -63.34 -39.73 95.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.908 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' 3584 ' ' ASP . 84.9 t -60.08 -41.48 86.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.945 178.62 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 4.9 t -62.59 -50.34 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 CA-C-O 121.555 0.693 . . . . 0.0 109.744 -178.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 37.1 m -59.84 -41.76 92.11 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 114.391 -1.277 . . . . 0.0 111.555 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -68.63 -38.23 80.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.48 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3592 ' ' THR . . . . . 0.437 ' O ' ' HG3' ' A' 3596 ' ' LYS . 86.6 m -58.55 -54.74 43.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.933 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -65.24 -33.4 75.9 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.965 -0.294 . . . . 0.0 111.2 -177.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 66.7 m -63.8 -45.94 87.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.421 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.568 HD12 ' HB2' ' A' 3599 ' ' PHE . 57.6 tp -62.95 -40.7 98.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.471 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.526 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 55.1 mtpt -58.74 -59.43 5.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.888 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.63 -29.53 69.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -174.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.64 -47.68 6.11 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -173.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.568 ' HB2' HD12 ' A' 3595 ' ' LEU . 23.5 m-85 -100.72 -50.26 3.92 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -174.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.526 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.4 mm -62.35 -58.59 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.893 -175.155 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 32.5 m -59.63 -31.61 69.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.237 -178.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.774 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -72.62 -58.61 3.23 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.812 177.752 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.774 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.37 -42.54 78.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.567 0.223 . . . . 0.0 111.56 -178.161 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -69.85 -38.15 76.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.6 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.22 -40.17 74.7 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.009 0.433 . . . . 0.0 110.499 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -73.98 -19.05 60.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.001 178.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3607 ' ' GLN . . . . . 0.496 ' O ' ' HG ' ' A' 3555 ' ' LEU . 85.6 mt-30 48.72 52.46 13.93 Favored 'General case' 0 C--O 1.23 0.068 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 -169.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.516 ' O ' HD12 ' A' 3603 ' ' LEU . . . -130.96 -175.96 3.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.978 -0.556 . . . . 0.0 112.197 -173.055 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.75 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.92 117.47 27.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.306 175.361 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.39 103.73 0.79 Allowed Glycine 0 C--O 1.222 -0.653 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.338 178.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.699 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.4 mm -89.28 120.23 37.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.207 0.527 . . . . 0.0 111.377 -173.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.662 HD13 ' HB3' ' A' 3547 ' ' LEU . 30.5 mt -122.53 105.29 15.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.825 175.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.529 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.8 m120 -83.65 125.06 31.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.866 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 34.5 m -117.15 140.13 26.76 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.443 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.66 ' HA ' ' O ' ' A' 3621 ' ' GLN . 93.2 Cg_endo -92.99 146.33 2.44 Favored 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 122.558 2.172 . . . . 0.0 112.137 172.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.681 ' HB2' ' HB2' ' A' 3619 ' ' SER . 19.7 m120 -59.61 124.63 76.77 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 172.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.64 109.83 0.47 Allowed 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.891 2.394 . . . . 0.0 112.63 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 97.97 -21.2 47.31 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.258 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3619 ' ' SER . . . . . 0.681 ' HB2' ' HB2' ' A' 3616 ' ' ASN . 14.5 m -99.41 -25.43 14.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.761 0.315 . . . . 0.0 110.678 -178.099 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3620 ' ' ASN . . . . . 0.412 ' O ' ' HD3' ' A' 3622 ' ' PRO . 6.0 m-20 63.29 29.26 15.84 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.823 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.66 ' O ' ' HA ' ' A' 3615 ' ' PRO . 75.8 mm-40 -93.68 105.9 18.7 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 176.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' 3620 ' ' ASN . 93.0 Cg_endo -87.55 24.83 0.69 Allowed 'Trans proline' 0 N--CA 1.463 -0.305 0 C-N-CA 123.458 2.772 . . . . 0.0 113.164 -174.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -76.41 23.36 0.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -174.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.529 ' O ' ' HA ' ' A' 3613 ' ' ASN . 79.3 m-85 -118.04 133.02 56.31 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 120.829 0.347 . . . . 0.0 110.492 -179.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.517 HG13 HG23 ' A' 3611 ' ' ILE . 9.9 t -122.74 115.75 46.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.237 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.663 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -95.55 110.03 22.17 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 170.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.495 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 61.5 mt-30 -94.5 110.74 22.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.692 -177.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.595 HG12 HG12 ' A' 3659 ' ' ILE . 31.6 mt -89.75 98.27 7.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.126 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -87.54 144.5 35.61 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.875 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.647 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 58.8 Cg_endo -71.7 170.18 19.3 Favored 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.576 2.184 . . . . 0.0 111.404 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3631 ' ' PRO . . . . . 0.4 ' HD3' ' O ' ' A' 3656 ' ' HIS . 36.9 Cg_endo -67.96 77.61 0.59 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.362 2.041 . . . . 0.0 110.969 174.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3632 ' ' CYS . . . . . 0.549 ' O ' ' HG2' ' A' 3636 ' ' GLU . 8.4 p -111.95 162.77 14.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.297 -171.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -48.84 -39.28 24.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.993 176.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 46.6 t80 -58.18 -55.95 28.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.231 176.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 33.8 p -66.23 -54.16 28.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.481 -174.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3636 ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.8 mm-40 -61.32 -35.15 76.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.795 -171.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 45.8 m -71.87 -46.0 59.38 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.058 0.456 . . . . 0.0 110.554 -178.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 53.0 m80 -63.32 -35.67 81.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.148 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.46 -32.9 74.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.031 176.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3640 ' ' SER . . . . . 1.088 ' HA ' HD22 ' A' 3647 ' ' LEU . 17.5 t -65.32 -35.76 81.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 0.0 110.08 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.97 -54.71 5.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.012 177.039 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.764 HD13 HD22 ' A' 3575 ' ' LEU . 28.2 mt -67.23 -39.62 86.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.463 -0.789 . . . . 0.0 112.821 -171.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.419 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -147.61 75.24 11.24 Favored Pre-proline 0 C--N 1.327 -0.385 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3644 ' ' PRO . . . . . 0.524 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 48.9 Cg_endo -69.52 -19.9 36.65 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.412 2.075 . . . . 0.0 111.752 178.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3645 ' ' ASP . . . . . 0.491 ' OD2' ' HG3' ' A' 3504 ' ' LYS . 43.6 m-20 -70.68 -51.66 26.22 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.026 -177.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.598 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -79.52 -28.01 41.35 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A 3647 ' ' LEU . . . . . 1.088 HD22 ' HA ' ' A' 3640 ' ' SER . 25.4 tp -52.06 -48.47 64.61 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.618 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3648 ' ' ALA . . . . . 0.407 ' HB1' HG11 ' A' 3496 ' ' VAL . . . -61.88 -20.33 63.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.492 -176.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 8.3 t -89.58 -33.56 16.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.175 178.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.606 ' HA ' HG22 ' A' 3653 ' ' ILE . 6.3 pt -80.81 -16.78 12.44 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.849 179.152 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 6.1 t -59.88 -21.14 60.62 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.41 0.624 . . . . 0.0 109.685 174.191 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -88.14 -39.21 14.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.353 174.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.606 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -105.22 43.15 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 122.461 1.124 . . . . 0.0 109.439 -179.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.471 ' N ' ' HD2' ' A' 3655 ' ' PRO . 20.3 m -37.19 -42.97 1.06 Allowed Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 113.98 -1.464 . . . . 0.0 113.524 172.453 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.52 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.8 Cg_endo -60.22 82.43 0.07 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.432 1.421 . . . . 0.0 111.661 168.348 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3656 ' ' HIS . . . . . 0.414 ' HB2' HD23 ' A' 3579 ' ' LEU . 25.7 p80 -148.18 174.64 11.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.145 -177.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.448 HD22 HG22 ' A' 3628 ' ' ILE . 39.1 mt -120.96 150.34 41.26 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.446 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 59.2 ttp -111.82 109.65 19.59 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 173.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.866 HD12 HD21 ' A' 3524 ' ' LEU . 83.5 mt -101.31 114.76 41.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 121.248 0.547 . . . . 0.0 111.19 -173.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.688 HG13 ' HD2' ' A' 3573 ' ' TYR . 72.4 t -101.1 114.54 40.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.799 -177.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.663 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.0 mt -90.51 112.09 24.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -117.12 129.21 55.82 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 120.882 0.372 . . . . 0.0 111.621 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 27.9 m -103.02 108.45 19.63 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 169.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.328 179.36 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.574 ' CD1' ' HB2' ' A' 3553 ' ' MET . 31.0 m-85 . . . . . 0 N--CA 1.482 1.134 0 CA-C-O 119.745 -0.169 . . . . 0.0 111.408 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.534 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.5 OUTLIER 53.49 -155.54 0.21 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.761 0.791 . . . . 0.0 111.419 179.143 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.465 ' H ' ' HB3' ' B' 2519 ' ' GLU . 98.5 m -153.14 123.22 6.98 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.577 -1.192 . . . . 0.0 107.996 167.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.573 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER -78.52 -134.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -177.999 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.967 ' HA ' ' HB3' ' B' 2525 ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B 2523 ' ' ASP . . . . . 0.638 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 11.1 p-10 -72.19 -36.78 69.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.366 173.354 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B 2525 ' ' GLU . . . . . 0.967 ' HB3' ' HA ' ' B' 2522 ' ' SEP . 10.1 tp10 . . . . . 0 C--O 1.247 0.957 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.761 -177.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.612 HG11 ' HB3' ' A' 3648 ' ' ALA . 12.3 t . . . . . 0 N--CA 1.479 1.007 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3497 ' ' ASP . . . . . 0.48 ' OD1' HG23 ' A' 3499 ' ' VAL . 13.3 t70 -105.41 154.54 20.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.03 -172.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3498 ' ' MET . . . . . 0.49 ' HA ' ' CD2' ' A' 3501 ' ' LEU . 72.7 mtm -67.77 -19.61 65.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.865 -176.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.48 HG23 ' OD1' ' A' 3497 ' ' ASP . 98.2 t -62.61 -23.13 31.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 121.253 0.549 . . . . 0.0 111.054 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -81.63 -57.51 3.42 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 121.926 -0.484 . . . . 0.0 110.796 175.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.573 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp -58.32 -38.14 76.5 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -175.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.646 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -69.82 -15.81 63.17 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.557 0.617 . . . . 0.0 110.243 -172.363 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.602 ' N ' HD13 ' A' 3502 ' ' LEU . 28.2 mtpp -68.21 -24.73 64.97 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.2 175.721 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.426 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 28.4 mmtp -101.59 -42.56 6.18 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.232 176.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.744 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -144.3 99.35 4.96 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-O 121.503 0.668 . . . . 0.0 110.533 179.414 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 3506 ' ' PRO . . . . . 0.646 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 92.6 Cg_endo -83.52 173.04 9.88 Favored 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 124.128 3.219 . . . . 0.0 113.958 -174.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.497 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 82.0 mt -73.64 138.6 20.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.394 -177.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 23.1 m -108.58 -31.42 2.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.217 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.818 ' CD1' HD12 ' A' 3524 ' ' LEU . 2.2 t-105 -138.75 148.84 44.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.391 -177.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -146.59 119.2 8.53 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 170.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3511 ' ' GLY . . . . . 0.471 ' O ' ' HA ' ' A' 3521 ' ' ALA . . . 177.97 -129.81 1.49 Allowed Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -175.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.604 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 4.9 mp -139.76 153.6 47.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.504 0.652 . . . . 0.0 111.931 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.466 HD23 ' HB2' ' A' 3547 ' ' LEU . 69.1 mt -106.15 154.12 21.13 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 167.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.673 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -142.83 121.86 12.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 117.97 0.35 . . . . 0.0 111.829 -177.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.758 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.34 147.09 41.08 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 172.797 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.758 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.8 OUTLIER 63.57 -99.25 0.07 Allowed 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -170.11 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -139.39 5.79 2.28 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.694 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 1.6 t0 -103.23 139.05 39.2 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.815 -172.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' 3514 ' ' ALA . 14.7 p -122.65 127.94 49.98 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.896 -177.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -115.74 115.51 26.46 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.602 177.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.604 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.01 112.67 6.57 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 121.299 0.571 . . . . 0.0 109.634 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.418 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 30.9 m -127.36 147.64 32.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.678 -176.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3523 ' ' GLN . . . . . 0.429 ' HG3' ' CE1' ' A' 3525 ' ' HIS . 20.2 pt20 -107.48 124.3 49.68 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.018 173.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.845 HD21 HD12 ' A' 3659 ' ' ILE . 4.8 mt -94.52 113.14 24.94 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.626 -176.368 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.497 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 56.5 m80 -91.03 142.6 27.6 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.688 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.744 ' O ' ' HB2' ' A' 3505 ' ' TYR . 60.0 t80 -70.02 137.31 51.24 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 172.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.571 ' CG1' HD23 ' A' 3575 ' ' LEU . 22.1 t -115.31 -55.8 4.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-O 121.383 0.611 . . . . 0.0 110.86 176.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.497 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 69.7 m -161.41 172.43 16.52 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.138 -171.253 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 84.51 -153.13 28.46 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.512 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.545 ' HB2' ' HA ' ' A' 3571 ' ' THR . 31.1 t30 -99.46 111.23 23.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.579 0.228 . . . . 0.0 111.102 -177.093 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -61.83 -29.02 69.89 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.313 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 98.7 t -58.79 -34.23 51.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.545 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.548 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 57.1 mt -59.3 -42.4 91.23 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.111 178.313 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.52 89.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.916 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -59.1 -38.72 80.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.166 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 9.0 ptm85 -88.5 -18.61 27.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -176.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.512 ' HB2' HD11 ' A' 3626 ' ' LEU . 43.9 p -92.27 -40.24 11.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.911 0.386 . . . . 0.0 111.193 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.629 HD13 ' HB2' ' A' 3509 ' ' TRP . 34.3 mt -79.39 120.98 82.29 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-O 121.108 0.48 . . . . 0.0 110.024 -174.105 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.95 -155.49 0.05 OUTLIER 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.429 2.752 . . . . 0.0 112.503 -177.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.487 ' HG ' ' HA3' ' A' 3544 ' ' GLY . 0.2 OUTLIER -107.91 148.49 29.56 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.253 176.836 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.24 -54.68 3.83 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.637 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3542 ' ' GLU . . . . . 0.474 ' H ' ' CD ' ' A' 3542 ' ' GLU . 1.2 pm0 -86.84 110.14 19.76 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.277 0.56 . . . . 0.0 110.102 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 94.67 -5.63 69.97 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -174.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3544 ' ' GLY . . . . . 0.487 ' HA3' ' HG ' ' A' 3540 ' ' LEU . . . -123.8 172.68 16.45 Favored Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 111.566 -0.613 . . . . 0.0 111.566 -179.142 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.409 ' HA ' ' HD3' ' A' 3546 ' ' PRO . 91.7 Cg_endo -91.58 134.8 1.61 Allowed 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 122.924 2.416 . . . . 0.0 112.843 177.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 36.5 Cg_exo -58.54 157.47 27.05 Favored 'Trans proline' 0 C--O 1.233 0.272 0 C-N-CA 122.817 2.344 . . . . 0.0 111.276 173.786 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.66 ' HB3' HD13 ' A' 3612 ' ' ILE . 36.9 mt -68.24 108.49 3.2 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' A' 3514 ' ' ALA . 19.3 ptt180 -97.41 138.48 34.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.056 0.455 . . . . 0.0 111.301 -175.711 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.465 HD12 HD22 ' A' 3515 ' ' LEU . 18.9 mt -91.15 106.68 17.82 Favored 'Isoleucine or valine' 0 C--O 1.247 0.938 0 CA-C-O 122.068 0.937 . . . . 0.0 111.105 -175.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.516 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.5 -1.45 14.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.81 -173.194 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.688 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 39.9 mt-30 -148.1 173.21 13.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.41 0.148 . . . . 0.0 110.863 177.007 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.608 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -150.91 140.91 22.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.004 0.431 . . . . 0.0 111.402 -179.686 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.669 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 21.7 ttt -109.53 124.93 51.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.089 178.257 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3554 ' ' ARG . . . . . 0.415 ' HG2' ' H ' ' A' 3554 ' ' ARG . 14.3 mmt180 -64.58 110.04 2.19 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.557 ' O ' HD12 ' A' 3555 ' ' LEU . 3.6 pp -79.24 97.57 6.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 118.559 -1.256 . . . . 0.0 108.605 176.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.552 ' O ' ' HG ' ' A' 3560 ' ' LEU . 44.9 mt-10 -118.07 164.03 15.73 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.471 -1.24 . . . . 0.0 109.225 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.484 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -49.99 -53.69 24.95 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.394 0.434 . . . . 0.0 111.52 -178.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 23.5 p -64.51 -39.81 94.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.482 -178.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.559 ' O ' HG23 ' A' 3563 ' ' VAL . 15.0 mm100 -66.75 -40.19 88.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.973 -179.089 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' 3556 ' ' GLU . 92.1 mt -61.19 -34.54 75.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.816 179.386 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.56 ' O ' ' HD3' ' A' 3565 ' ' ARG . 7.9 mm-40 -60.19 -49.67 76.69 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 174.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.58 -41.42 99.57 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.702 178.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' 3559 ' ' GLN . 57.7 t -60.43 -44.77 96.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.731 0.301 . . . . 0.0 110.28 177.37 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -57.2 -36.82 71.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.394 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.56 ' HD3' ' O ' ' A' 3561 ' ' GLU . 10.5 mpt_? -58.31 -45.15 88.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.735 -0.211 . . . . 0.0 111.506 179.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3566 ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' 3563 ' ' VAL . 18.8 ptp180 -78.77 -16.34 57.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.861 0.362 . . . . 0.0 110.452 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.446 ' HG3' ' O ' ' A' 3563 ' ' VAL . 80.8 mtp -85.45 -22.01 28.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.575 0.702 . . . . 0.0 109.92 176.329 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 1.4 m -74.82 -23.46 58.47 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.26 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 39.7 t -98.01 87.76 1.64 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.358 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -74.23 107.72 6.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.545 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.6 m 150.57 -44.76 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.436 1.494 . . . . 0.0 107.769 -172.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.61 -31.1 24.45 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.832 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.861 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -119.62 158.93 25.39 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.213 0.53 . . . . 0.0 109.777 177.395 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.602 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 42.2 t -122.4 136.87 54.98 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 170.596 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.771 HD22 HD13 ' A' 3642 ' ' LEU . 14.2 tp -104.81 125.69 51.12 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.678 HD11 HD11 ' A' 3661 ' ' ILE . 70.6 mt -126.35 154.7 43.16 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.546 -177.383 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.692 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -122.08 107.03 11.72 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.099 179.697 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.517 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.14 120.25 34.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.489 0.662 . . . . 0.0 110.356 -178.403 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.547 ' HG ' HD12 ' A' 3577 ' ' LEU . 57.8 mt -122.18 146.34 46.49 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.791 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.23 116.9 3.56 Favored 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.145 1.897 . . . . 0.0 111.551 176.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 30.3 p -104.43 117.07 33.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.117 0.484 . . . . 0.0 109.97 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3582 ' ' GLY . . . . . 0.478 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.42 138.59 14.08 Favored Glycine 0 N--CA 1.437 -1.271 0 C-N-CA 120.262 -0.971 . . . . 0.0 111.82 178.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3583 ' ' ARG . . . . . 0.488 ' HG3' ' OD2' ' A' 3587 ' ' ASP . 33.0 mtt85 -70.24 -30.46 67.53 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.706 0.765 . . . . 0.0 109.093 177.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.505 ' O ' HG23 ' A' 3588 ' ' VAL . 3.9 p30 -140.04 174.57 10.39 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.956 178.192 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -60.47 -40.73 92.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.825 0.345 . . . . 0.0 111.115 -175.109 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3586 ' ' GLU . . . . . 0.412 ' HB3' ' OD1' ' A' 3584 ' ' ASP . 35.0 tt0 -67.19 -44.41 79.7 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.057 0.456 . . . . 0.0 109.922 178.023 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.488 ' OD2' ' HG3' ' A' 3583 ' ' ARG . 5.5 t70 -55.98 -45.68 78.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.58 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' 3584 ' ' ASP . 74.1 t -55.26 -54.7 22.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.828 178.048 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 82.1 t -58.4 -46.75 89.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.353 -178.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 46.9 t -60.54 -49.8 76.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.198 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -67.36 -30.34 70.11 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -177.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 83.2 m -61.92 -48.21 81.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.998 0.428 . . . . 0.0 110.026 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.9 -46.31 71.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.25 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 19.3 m -55.45 -47.51 75.93 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.517 178.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.608 HD12 ' HB2' ' A' 3599 ' ' PHE . 65.3 tp -63.57 -41.91 98.35 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.01 0.433 . . . . 0.0 110.332 176.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.593 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 1.9 ttmt -61.18 -50.12 74.45 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.011 -179.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3597 ' ' ALA . . . . . 0.419 ' N ' ' HG2' ' A' 3596 ' ' LYS . . . -73.66 -35.78 65.27 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -179.266 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.534 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -90.49 -46.35 8.38 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -171.431 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.633 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 11.6 m-85 -99.58 -50.0 4.22 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.822 0.344 . . . . 0.0 111.387 -175.371 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 28.5 mm -62.12 -58.69 6.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.735 -176.307 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 59.2 m -57.75 -38.54 75.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.247 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.694 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -67.72 -53.13 29.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.749 0.309 . . . . 0.0 110.627 179.277 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.694 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -69.21 -34.53 75.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.148 -170.225 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -70.58 -36.82 73.78 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.45 -37.71 74.36 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.816 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3606 ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' A' 3602 ' ' TYR . 72.4 mmtt -73.56 -19.51 60.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.703 178.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3607 ' ' GLN . . . . . 0.447 ' O ' ' HG ' ' A' 3555 ' ' LEU . 74.6 mt-30 48.95 50.68 17.39 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -169.053 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -132.92 170.67 15.0 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.245 -172.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.669 ' HB3' ' HB3' ' A' 3553 ' ' MET . . . -105.27 118.15 35.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.258 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.68 105.89 1.3 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.336 177.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.688 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 34.4 mm -90.02 122.1 41.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-O 121.22 0.533 . . . . 0.0 111.181 -174.323 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.66 HD13 ' HB3' ' A' 3547 ' ' LEU . 32.4 mt -120.84 117.08 51.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.702 175.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 14.9 m120 -95.42 126.01 40.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.356 -176.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 32.1 m -123.83 147.17 52.88 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.351 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.503 ' HA ' ' O ' ' A' 3621 ' ' GLN . 92.5 Cg_endo -92.12 142.05 2.48 Favored 'Trans proline' 0 N--CA 1.445 -1.344 0 C-N-CA 122.363 2.042 . . . . 0.0 112.395 173.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3616 ' ' ASN . . . . . . . . . . . . . 42.0 t30 -65.13 118.12 46.49 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.854 175.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.74 119.03 5.34 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 123.149 2.566 . . . . 0.0 112.563 -177.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 105.02 -43.16 1.72 Allowed Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.948 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 16.4 m -88.87 -26.03 21.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.678 0.275 . . . . 0.0 110.581 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 6.0 t30 63.0 39.19 10.42 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.815 0.817 . . . . 0.0 109.378 -177.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.503 ' O ' ' HA ' ' A' 3615 ' ' PRO . 8.8 tp-100 -102.0 107.56 52.97 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.246 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3622 ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -78.39 24.33 0.56 Allowed 'Trans proline' 0 CA--C 1.528 0.209 0 C-N-CA 123.239 2.626 . . . . 0.0 112.779 -178.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -79.77 37.46 0.36 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.494 -177.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3624 ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -128.72 132.12 47.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.136 0.493 . . . . 0.0 110.131 176.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.519 HG12 ' HG3' ' A' 3627 ' ' GLN . 2.8 t -124.23 118.01 52.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.059 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -96.28 111.3 23.41 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 171.389 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.53 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 76.2 mt-30 -94.18 110.94 22.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.953 -178.372 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.592 HG12 HG12 ' A' 3659 ' ' ILE . 26.3 mt -92.94 99.46 9.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.356 -179.409 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -89.01 138.08 29.34 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.001 178.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.631 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 45.0 Cg_endo -68.05 168.83 17.91 Favored 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.639 2.226 . . . . 0.0 111.186 176.394 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -65.36 81.43 0.22 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.469 2.113 . . . . 0.0 111.673 177.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3632 ' ' CYS . . . . . 0.542 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.9 p -113.24 162.6 15.82 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.523 -176.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -54.89 -35.81 64.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.832 0.349 . . . . 0.0 110.323 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 40.0 t80 -53.96 -53.59 50.77 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.114 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3635 ' ' SER . . . . . 0.423 ' O ' ' HG ' ' A' 3639 ' ' LEU . 49.9 p -69.92 -53.65 16.95 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.873 -177.543 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3636 ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' 3632 ' ' CYS . 20.6 mm-40 -61.12 -43.86 98.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.857 -172.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 41.6 t -66.56 -43.49 84.88 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.118 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 12.6 m80 -64.0 -36.22 83.27 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.544 176.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3639 ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' 3635 ' ' SER . 79.0 mt -64.93 -42.37 94.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.959 177.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.779 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 36.6 t -58.41 -35.13 71.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.267 0.556 . . . . 0.0 110.448 178.042 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -79.83 -50.24 10.8 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.823 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.771 HD13 HD22 ' A' 3575 ' ' LEU . 19.7 mt -75.31 -38.3 60.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.46 -171.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.467 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -146.54 87.56 6.4 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.806 0.336 . . . . 0.0 111.332 -179.429 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.66 -24.98 21.19 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.587 2.191 . . . . 0.0 113.712 -174.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 4.1 t70 -80.31 -40.28 27.1 Favored 'General case' 0 CA--C 1.513 -0.444 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.534 -171.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.692 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.82 -29.4 44.75 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 176.559 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.779 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.26 -44.64 71.99 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.046 176.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3648 ' ' ALA . . . . . 0.612 ' HB3' HG11 ' A' 3496 ' ' VAL . . . -59.37 -34.58 72.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.903 0.382 . . . . 0.0 111.067 -179.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 18.9 m -71.15 -41.8 69.96 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.916 0.389 . . . . 0.0 110.684 177.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.579 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.2 pt -79.59 -17.58 12.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.514 -173.33 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 48.8 m -57.74 -26.14 61.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.148 0.499 . . . . 0.0 110.441 174.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -87.4 -37.39 17.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.141 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.579 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.2 tp -104.91 43.64 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 122.406 1.098 . . . . 0.0 109.198 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.476 ' N ' ' HD2' ' A' 3655 ' ' PRO . 7.7 t -37.63 -43.46 1.41 Allowed Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 114.003 -1.453 . . . . 0.0 113.22 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.532 ' HG2' HD12 ' A' 3653 ' ' ILE . 15.3 Cg_endo -59.16 87.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 121.437 1.425 . . . . 0.0 111.601 169.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -154.83 177.95 10.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.399 -177.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.5 ' HB3' HG23 ' A' 3628 ' ' ILE . 43.5 mt -126.78 133.47 50.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.658 -179.058 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.7 tmm? -99.69 112.56 24.79 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.845 HD12 HD21 ' A' 3524 ' ' LEU . 75.8 mt -108.93 120.86 61.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 121.331 0.586 . . . . 0.0 111.838 -170.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.861 HG13 ' HD2' ' A' 3573 ' ' TYR . 63.7 t -103.65 116.64 47.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.779 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.678 HD11 HD11 ' A' 3576 ' ' LEU . 57.8 mt -90.69 111.78 24.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 176.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.51 128.68 56.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.781 0.324 . . . . 0.0 111.404 -176.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 14.8 m -77.66 119.82 21.74 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.885 173.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 52.6 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.677 -0.677 . . . . 0.0 109.713 177.72 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.473 ' CD2' ' HB2' ' A' 3553 ' ' MET . 42.4 m-85 . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 111.347 0.129 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.987 ' HG3' ' H ' ' B' 2520 ' ' THR . 6.7 tp10 58.0 -150.79 0.43 Allowed 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 177.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.987 ' H ' ' HG3' ' B' 2519 ' ' GLU . 33.7 m -154.98 126.59 7.44 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 174.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.649 ' HG ' ' N ' ' B' 2522 ' ' SEP . 36.2 tp -87.75 -128.65 0.06 Allowed 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.709 176.764 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.649 ' N ' ' HG ' ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B 2523 ' ' ASP . . . . . 0.608 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 1.0 OUTLIER -158.61 -60.84 0.08 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.748 -176.756 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 . . . . . 0 C--O 1.244 0.769 0 CA-C-O 118.638 -0.696 . . . . 0.0 110.151 176.246 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.892 HG13 ' HB3' ' A' 3649 ' ' SER . 58.5 t . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -106.22 111.81 24.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.855 0.36 . . . . 0.0 111.265 -178.433 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 84.7 mtp -79.53 -33.95 41.53 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.879 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 41.4 t -62.9 -23.35 32.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.293 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -81.76 -58.9 2.79 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 122.055 -0.403 . . . . 0.0 111.005 176.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.571 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp -64.5 -33.98 77.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -173.228 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.626 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.38 -15.61 63.78 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.682 -173.929 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.626 ' N ' HD13 ' A' 3502 ' ' LEU . 23.3 ttmm -61.46 -38.42 87.17 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.063 0.459 . . . . 0.0 110.14 176.096 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.558 ' HD2' ' CD2' ' A' 3505 ' ' TYR . 7.5 tmtt? -94.66 -41.96 9.02 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.354 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.744 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -144.4 100.89 4.77 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.375 -177.111 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -87.61 173.43 5.33 Favored 'Trans proline' 0 CA--C 1.531 0.356 0 C-N-CA 124.257 3.304 . . . . 0.0 113.364 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.509 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 85.9 mt -71.6 128.96 35.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.719 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.472 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.0 m -98.48 -29.69 3.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.36 -178.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.571 ' CB ' HD13 ' A' 3538 ' ' LEU . 6.4 t-105 -153.57 158.16 40.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.21 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 25.1 tt0 -150.45 119.76 6.84 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 177.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.16 -132.56 1.41 Allowed Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.758 -0.734 . . . . 0.0 111.276 -176.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.635 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -139.85 153.21 46.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.056 0.455 . . . . 0.0 111.063 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.484 HD23 ' HB2' ' A' 3547 ' ' LEU . 73.7 mt -110.58 150.53 28.81 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 171.276 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.681 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.3 125.42 15.4 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -177.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.577 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.67 143.98 39.42 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 171.89 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.577 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.2 OUTLIER 62.29 -94.94 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 -168.784 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 13.4 m120 -142.66 5.74 1.6 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.727 174.187 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.411 ' O ' ' HA ' ' A' 3514 ' ' ALA . 26.4 m-20 -92.96 136.18 33.49 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.964 0.412 . . . . 0.0 110.727 -175.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.525 HG22 ' HB2' ' A' 3514 ' ' ALA . 13.4 p -123.98 140.69 52.73 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.219 -177.002 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.41 115.65 14.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.12 176.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.635 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -69.7 118.63 12.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.212 0.529 . . . . 0.0 109.857 175.27 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 27.3 m -131.07 147.55 33.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.82 -176.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -105.59 125.74 51.34 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.036 173.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.833 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -95.24 108.17 20.31 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.805 -175.797 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.509 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 71.4 m-70 -83.75 140.97 31.76 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.678 174.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.744 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.4 t80 -68.6 140.58 55.56 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 172.558 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.575 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.5 t -116.15 -53.06 4.58 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.373 0.606 . . . . 0.0 110.903 175.591 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.453 ' OG ' HD22 ' A' 3642 ' ' LEU . 39.4 t -162.38 170.81 18.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.268 -171.277 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.54 -147.83 20.19 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.885 176.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.544 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.8 t-20 -107.99 114.66 28.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.853 0.358 . . . . 0.0 110.845 -177.153 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -62.17 -32.37 72.98 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.811 -177.101 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3532 ' ' VAL . . . . . 0.518 ' O ' ' HG2' ' A' 3536 ' ' ARG . 45.4 t -60.06 -35.6 62.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.148 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.494 HD23 ' HD3' ' A' 3536 ' ' ARG . 16.9 mt -55.6 -40.24 71.79 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.404 177.525 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.503 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.31 -44.57 83.08 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.452 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 5.2 t60 -63.82 -32.49 74.02 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.049 -178.496 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.518 ' HG2' ' O ' ' A' 3532 ' ' VAL . 10.8 ptm180 -88.62 -11.69 44.73 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.196 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.491 ' HB2' HD11 ' A' 3626 ' ' LEU . 34.2 p -103.92 -40.37 6.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 111.396 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.571 HD13 ' CB ' ' A' 3509 ' ' TRP . 16.7 mt -80.2 114.42 46.76 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -176.22 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3539 ' ' PRO . . . . . 0.424 ' HB2' ' HG2' ' A' 3545 ' ' PRO . 30.3 Cg_endo -64.84 136.31 48.43 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.174 1.916 . . . . 0.0 111.871 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 3.2 pp -170.96 142.39 1.85 Allowed 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.599 -177.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 12.0 t -168.7 -38.04 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.092 -178.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -160.03 99.79 1.38 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.846 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 100.29 -88.48 0.77 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.855 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 155.68 101.14 0.18 Allowed Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.326 179.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.52 ' HA ' ' HD3' ' A' 3546 ' ' PRO . 14.3 Cg_exo -69.36 136.2 33.42 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.956 2.437 . . . . 0.0 111.642 177.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.52 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 6.3 Cg_exo -76.59 124.78 7.83 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.445 2.097 . . . . 0.0 112.318 -179.16 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.671 ' HB3' HD13 ' A' 3612 ' ' ILE . 42.7 mt -69.32 110.93 4.9 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.015 176.399 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.681 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -96.97 138.37 34.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.116 0.484 . . . . 0.0 111.103 -177.541 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.5 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.3 mt -87.93 112.38 23.5 Favored 'Isoleucine or valine' 0 C--O 1.242 0.666 0 CA-C-O 121.872 0.844 . . . . 0.0 111.422 -173.227 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.592 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -121.47 4.9 10.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.786 -174.564 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.714 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 48.8 mt-30 -152.23 173.06 15.46 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.63 177.081 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.743 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.47 139.41 11.76 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.855 0.359 . . . . 0.0 111.654 -179.478 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.594 ' HB2' ' CD2' ' B' 2518 ' ' TYR . 13.7 tmm? -111.92 120.11 40.79 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.076 176.236 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -68.55 110.01 4.01 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.596 ' O ' HD12 ' A' 3555 ' ' LEU . 2.5 pp -69.77 98.38 1.2 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 122.241 1.02 . . . . 0.0 110.006 -175.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.614 ' O ' ' HG ' ' A' 3560 ' ' LEU . 38.1 mm-40 -116.83 159.16 22.78 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.535 179.516 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.509 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -50.19 -50.13 50.29 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.321 0.388 . . . . 0.0 111.392 -177.149 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 5.9 p -63.28 -43.91 96.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.646 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.481 ' O ' HG23 ' A' 3563 ' ' VAL . 16.9 mm-40 -66.28 -38.97 89.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.302 -178.257 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' 3556 ' ' GLU . 87.4 mt -61.95 -35.02 77.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.568 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' 3557 ' ' ALA . 76.1 mm-40 -60.91 -47.17 87.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.951 174.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -59.49 -35.74 86.61 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.637 176.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.523 ' O ' ' HG3' ' A' 3567 ' ' MET . 60.2 t -67.5 -53.66 30.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.828 0.347 . . . . 0.0 110.208 176.619 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3564 ' ' ALA . . . . . 0.486 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.1 -26.58 66.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.489 -178.461 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -58.33 -40.25 81.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3566 ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' 3563 ' ' VAL . 12.0 ptp180 -88.38 -14.3 38.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.927 0.394 . . . . 0.0 110.791 177.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.523 ' HG3' ' O ' ' A' 3563 ' ' VAL . 88.1 mtp -79.03 -26.61 43.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.166 -178.886 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 8.5 t -74.99 -9.09 58.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.059 0.457 . . . . 0.0 110.644 -178.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 42.3 t -115.95 91.15 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.061 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -70.43 108.06 4.1 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 178.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.544 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.0 m 153.19 -46.22 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 O-C-N 125.046 1.466 . . . . 0.0 108.089 -173.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.31 -25.94 33.51 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.929 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.684 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -128.91 162.6 27.15 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.016 177.751 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.651 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 31.1 t -126.53 135.14 50.91 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.753 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.83 125.97 51.62 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.605 HD11 HD11 ' A' 3661 ' ' ILE . 67.7 mt -126.3 155.88 41.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.297 0.57 . . . . 0.0 111.035 -176.664 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.583 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -124.24 107.06 10.8 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.94 -179.689 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.472 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.64 119.74 33.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.379 0.609 . . . . 0.0 110.346 -177.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.445 ' HG ' HD12 ' A' 3577 ' ' LEU . 74.5 mt -119.44 143.78 35.23 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.238 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.93 112.8 1.4 Allowed 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 122.429 2.086 . . . . 0.0 111.641 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 28.5 p -101.93 113.49 26.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.196 0.522 . . . . 0.0 110.517 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.85 145.43 16.12 Favored Glycine 0 N--CA 1.438 -1.175 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.967 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3583 ' ' ARG . . . . . 0.473 ' HE ' ' CG ' ' A' 3587 ' ' ASP . 45.6 mtm180 -71.69 -34.46 69.67 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.697 0.76 . . . . 0.0 109.962 178.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.542 ' O ' HG23 ' A' 3588 ' ' VAL . 14.5 t70 -133.35 165.97 23.61 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.192 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3585 ' ' GLN . . . . . 0.416 ' O ' HG23 ' A' 3589 ' ' VAL . 36.2 tt0 -53.82 -37.46 63.59 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.069 0.461 . . . . 0.0 110.299 176.603 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -65.99 -44.8 83.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.279 176.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.504 ' HB3' ' H ' ' A' 3584 ' ' ASP . 14.8 t70 -64.46 -41.02 96.76 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.633 -177.445 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' 3584 ' ' ASP . 88.7 t -56.93 -48.0 82.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.321 178.183 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3589 ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' 3585 ' ' GLN . 88.9 t -59.0 -47.34 90.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.391 178.38 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 22.4 t -62.53 -41.59 98.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.006 -179.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -67.95 -38.26 82.59 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 122.318 -0.239 . . . . 0.0 110.761 178.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3592 ' ' THR . . . . . 0.528 HG22 ' HE2' ' A' 3596 ' ' LYS . 44.9 m -62.6 -52.24 64.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.702 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.6 pt-20 -62.71 -41.76 99.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.619 0.247 . . . . 0.0 111.146 -178.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.5 m -61.23 -46.64 89.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.852 0.358 . . . . 0.0 110.572 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.588 HD12 ' HB2' ' A' 3599 ' ' PHE . 50.3 tp -63.48 -42.55 98.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.762 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.562 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 57.7 mtmt -62.53 -45.53 92.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.506 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.03 -33.32 59.63 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.513 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -93.94 -46.65 7.07 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -172.039 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.724 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 21.4 m-85 -100.55 -50.93 3.74 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -176.214 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.562 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.0 mm -61.51 -60.9 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.276 -174.243 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 60.8 m -59.4 -40.59 87.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.3 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.724 ' HD2' ' HA ' ' A' 3599 ' ' PHE . 0.0 OUTLIER -65.04 -50.38 66.45 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.838 0.351 . . . . 0.0 110.835 -179.726 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.703 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -70.36 -36.05 73.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.911 -170.528 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -75.78 -29.17 58.68 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.942 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.31 -40.34 77.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.122 0.486 . . . . 0.0 110.175 176.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -73.46 -19.1 61.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.266 177.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3607 ' ' GLN . . . . . 0.446 ' O ' ' HG ' ' A' 3555 ' ' LEU . 46.4 mt-30 46.97 58.31 4.89 Favored 'General case' 0 C--O 1.232 0.161 0 O-C-N 123.815 0.697 . . . . 0.0 109.139 -168.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.425 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -140.88 174.59 10.37 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.38 0.61 . . . . 0.0 112.214 -172.194 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.743 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -108.28 117.54 34.43 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.453 174.26 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -65.34 103.73 0.85 Allowed Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 176.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.714 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 29.8 mm -89.32 123.37 41.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 121.374 0.607 . . . . 0.0 110.902 -174.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.671 HD13 ' HB3' ' A' 3547 ' ' LEU . 48.0 mt -120.82 111.92 33.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.179 174.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 6.6 m120 -88.84 136.18 33.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.872 -175.062 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.502 ' HB ' ' HB2' ' A' 3624 ' ' TYR . 46.1 t -116.55 122.97 31.08 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-O 120.766 0.317 . . . . 0.0 110.193 178.396 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.545 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 73.0 Cg_endo -100.25 141.19 0.29 Allowed 'Trans proline' 0 N--CA 1.444 -1.386 0 C-N-CA 123.333 2.689 . . . . 0.0 113.635 176.467 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.718 ' HB3' ' HB2' ' A' 3619 ' ' SER . 12.0 m120 -124.84 97.85 37.81 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 171.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -48.9 101.62 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 123.516 2.81 . . . . 0.0 113.026 -174.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 80.65 -26.83 3.04 Favored Glycine 0 CA--C 1.52 0.399 0 CA-C-N 115.969 -0.56 . . . . 0.0 113.039 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3619 ' ' SER . . . . . 0.718 ' HB2' ' HB3' ' A' 3616 ' ' ASN . 5.0 m -78.65 -34.91 46.02 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.741 -0.27 . . . . 0.0 111.587 -174.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3620 ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' 3621 ' ' GLN . 5.5 t30 -160.92 -6.72 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.554 -178.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.845 ' HB3' ' HD2' ' A' 3622 ' ' PRO . 26.3 mp0 66.99 178.4 0.05 OUTLIER Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.412 -178.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.845 ' HD2' ' HB3' ' A' 3621 ' ' GLN . 48.5 Cg_endo -68.92 25.59 0.15 Allowed 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 123.091 2.528 . . . . 0.0 113.592 175.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3623 ' ' ALA . . . . . 0.43 ' H ' ' C ' ' A' 3621 ' ' GLN . . . -75.67 35.73 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -176.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.502 ' HB2' ' HB ' ' A' 3614 ' ' VAL . 64.6 m-85 -124.16 134.03 53.42 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 175.228 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.421 HG13 HD12 ' A' 3611 ' ' ILE . 2.9 t -130.68 116.65 35.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.79 175.084 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.6 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -100.84 113.79 27.04 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 170.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.528 ' O ' ' HA ' ' A' 3659 ' ' ILE . 78.5 mt-30 -94.41 111.09 22.83 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.715 -178.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.596 HG12 HG12 ' A' 3659 ' ' ILE . 44.9 mt -92.24 98.62 8.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-O 121.024 0.44 . . . . 0.0 110.181 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3629 ' ' PHE . . . . . 0.437 ' CE1' ' HB2' ' A' 3609 ' ' ALA . 84.1 m-85 -89.42 141.21 28.71 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.973 178.389 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.487 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 39.8 Cg_endo -67.05 172.93 9.14 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.583 2.188 . . . . 0.0 111.077 176.047 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -68.95 41.85 0.28 Allowed 'Trans proline' 0 CA--C 1.535 0.57 0 C-N-CA 122.739 2.293 . . . . 0.0 112.724 175.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3632 ' ' CYS . . . . . 0.502 ' O ' ' HG2' ' A' 3636 ' ' GLU . 27.0 p -77.4 162.1 27.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.726 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -54.9 -35.23 63.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.303 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 28.6 t80 -53.9 -52.33 60.87 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.004 0.43 . . . . 0.0 110.601 176.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 7.1 m -62.46 -56.64 16.25 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.654 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3636 ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.5 mm-40 -58.3 -43.05 87.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.869 -172.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 35.6 p -62.8 -47.91 81.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.055 0.455 . . . . 0.0 110.754 -178.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 69.4 m80 -66.9 -34.76 78.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.436 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3639 ' ' LEU . . . . . 0.435 HD23 HG11 ' A' 3527 ' ' VAL . 82.1 mt -63.48 -32.85 74.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.841 175.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.688 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 19.3 m -69.44 -33.8 73.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.198 0.523 . . . . 0.0 110.399 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -84.13 -34.52 24.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.337 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.753 HD13 HD22 ' A' 3575 ' ' LEU . 19.3 mt -93.73 -24.56 17.78 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -172.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -154.54 75.0 5.83 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.628 0.251 . . . . 0.0 111.388 178.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.77 -24.9 61.24 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.599 2.199 . . . . 0.0 113.417 -175.155 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 10.0 t70 -75.78 -55.15 5.91 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.589 ' HB3' ' CE1' ' A' 3505 ' ' TYR . 0.1 OUTLIER -68.13 -30.57 69.75 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 179.858 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.688 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -53.96 -47.63 71.12 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.217 176.261 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -65.55 -19.07 65.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.874 0.368 . . . . 0.0 111.189 -178.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.892 ' HB3' HG13 ' A' 3496 ' ' VAL . 70.8 m -87.74 -35.35 17.96 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.872 176.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.632 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.1 pt -79.94 -15.21 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.063 -178.102 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 49.0 m -61.92 -20.36 63.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.085 0.469 . . . . 0.0 110.181 175.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -88.31 -38.12 15.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.27 173.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.632 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -104.42 44.07 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 122.508 1.147 . . . . 0.0 108.853 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.467 ' N ' ' HD2' ' A' 3655 ' ' PRO . 16.1 m -32.62 -47.69 0.51 Allowed Pre-proline 0 N--CA 1.468 0.435 0 CA-C-N 113.624 -1.625 . . . . 0.0 113.174 171.122 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.497 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.7 Cg_endo -59.08 88.71 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.605 1.537 . . . . 0.0 111.9 170.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -154.66 169.64 23.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.369 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.458 ' HB3' HG23 ' A' 3628 ' ' ILE . 56.9 mt -121.88 133.71 54.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.371 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.7 tmm? -100.38 111.65 23.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.833 HD12 HD21 ' A' 3524 ' ' LEU . 75.9 mt -106.36 120.27 57.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.59 -170.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.684 HG13 ' HD2' ' A' 3573 ' ' TYR . 87.9 t -103.76 114.83 44.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.884 -178.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.651 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 69.7 mt -91.15 120.17 39.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.059 177.659 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -116.62 126.27 53.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.658 0.266 . . . . 0.0 110.763 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 23.4 p -96.91 122.85 40.34 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.282 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 33.8 t . . . . . 0 C--O 1.251 1.181 0 O-C-N 123.561 0.538 . . . . 0.0 110.983 178.531 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.594 ' CD2' ' HB2' ' A' 3553 ' ' MET . 7.2 m-85 . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 111.454 0.168 . . . . 0.0 111.454 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.847 ' HG2' ' H ' ' B' 2520 ' ' THR . 54.6 tt0 56.97 -150.11 0.45 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.847 ' H ' ' HG2' ' B' 2519 ' ' GLU . 5.9 t -167.32 132.34 1.99 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 175.156 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.736 HD12 HH11 ' A' 3552 ' ' ARG . 1.4 tp -87.16 -118.53 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 120.415 -0.514 . . . . 0.0 110.019 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B 2522 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 25.8 t70 -149.51 -65.6 0.22 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.963 172.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 3.4 mp0 . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.46 -0.781 . . . . 0.0 109.789 179.147 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.653 HG13 ' HB3' ' A' 3649 ' ' SER . 48.8 t . . . . . 0 N--CA 1.477 0.902 0 CA-C-O 121.02 0.438 . . . . 0.0 110.414 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 13.7 t70 -99.98 110.68 22.99 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 176.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 72.6 mtm -82.9 -9.98 59.04 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.148 0.499 . . . . 0.0 111.285 -177.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 15.0 t -72.53 -21.13 19.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.094 -176.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -83.18 -59.07 2.59 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.879 -0.513 . . . . 0.0 111.515 176.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.552 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp -55.29 -36.56 66.29 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.33 0.863 . . . . 0.0 113.33 -176.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.705 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -69.22 -15.31 63.35 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.501 -173.798 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.61 ' N ' HD13 ' A' 3502 ' ' LEU . 52.2 tptt -68.71 -24.0 64.43 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.541 176.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3504 ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 60.6 mmtt -100.32 -43.03 6.4 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.037 174.622 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.708 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -149.16 104.07 3.34 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.637 -179.104 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3506 ' ' PRO . . . . . 0.705 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 84.5 Cg_endo -84.51 173.97 8.16 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 123.988 3.125 . . . . 0.0 113.938 -174.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.414 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 86.4 mt -71.83 133.42 31.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.915 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 26.9 m -100.94 -30.59 3.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.51 -178.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.636 ' CB ' HD13 ' A' 3538 ' ' LEU . 34.1 t-105 -150.23 149.72 30.57 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -143.77 119.35 10.4 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -174.48 -127.46 1.01 Allowed Glycine 0 N--CA 1.443 -0.853 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 -177.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.629 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -138.96 158.5 44.09 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.176 0.512 . . . . 0.0 111.124 177.533 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.494 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.7 mt -108.93 148.88 30.01 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 168.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.717 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -142.85 129.33 20.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.848 0.356 . . . . 0.0 111.182 -179.076 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.631 HD12 HD21 ' B' 2521 ' ' LEU . 0.2 OUTLIER -137.32 138.15 39.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 171.655 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.697 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.1 OUTLIER 63.94 -93.96 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -168.693 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -144.28 10.25 1.47 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.353 173.28 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.472 ' O ' ' HA ' ' A' 3514 ' ' ALA . 8.8 m-20 -86.72 132.98 33.71 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.218 -177.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 24.7 p -122.5 129.86 52.43 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.324 0.583 . . . . 0.0 111.945 -175.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -130.71 115.03 16.12 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.075 173.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.629 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.74 125.11 25.93 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.478 HG21 ' HG ' ' A' 3513 ' ' LEU . 35.0 m -130.91 149.53 33.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.585 0.707 . . . . 0.0 111.972 -174.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -113.0 124.09 51.84 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.304 170.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.796 HD21 HD12 ' A' 3659 ' ' ILE . 0.8 OUTLIER -94.01 111.21 22.9 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.636 -174.319 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.424 ' CE1' HD12 ' A' 3579 ' ' LEU . 74.4 m80 -88.72 136.34 33.05 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.981 -1.008 . . . . 0.0 108.928 177.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.708 ' O ' ' HB2' ' A' 3505 ' ' TYR . 61.0 t80 -67.6 138.31 56.33 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.566 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.9 t -114.59 -56.67 4.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.243 0.544 . . . . 0.0 110.812 176.111 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.453 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 61.4 m -160.52 171.4 19.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.91 -171.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.19 -152.77 23.01 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.8 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.504 ' HB2' ' HA ' ' A' 3571 ' ' THR . 48.1 t-20 -91.97 111.3 22.78 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -177.668 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -64.26 -33.21 75.3 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.929 0.395 . . . . 0.0 110.788 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 60.6 t -62.52 -30.34 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.294 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.564 HD23 ' HD3' ' A' 3536 ' ' ARG . 15.8 mt -59.47 -41.42 89.72 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.354 178.271 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -68.96 -41.35 78.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.986 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 80.7 t60 -63.69 -33.64 76.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.111 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.564 ' HD3' HD23 ' A' 3533 ' ' LEU . 14.4 ptm180 -89.92 -11.73 40.94 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.225 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.47 ' O ' HG11 ' A' 3614 ' ' VAL . 47.5 p -103.7 -38.28 7.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.728 0.299 . . . . 0.0 111.522 -179.163 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.636 HD13 ' CB ' ' A' 3509 ' ' TRP . 20.3 mt -81.42 110.11 17.34 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.955 0.407 . . . . 0.0 110.005 -176.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3539 ' ' PRO . . . . . 0.805 ' HB2' ' HA3' ' A' 3543 ' ' GLY . 58.6 Cg_endo -76.54 156.2 36.14 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.936 2.424 . . . . 0.0 113.03 -175.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.5 ' HB3' ' CZ3' ' A' 3509 ' ' TRP . 0.8 OUTLIER -162.42 146.28 11.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.606 -179.173 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 50.6 m 70.79 -40.72 0.48 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.824 0.85 . . . . 0.0 111.233 -177.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3542 ' ' GLU . . . . . 0.414 ' H ' ' C ' ' A' 3540 ' ' LEU . 0.4 OUTLIER -109.42 -14.93 14.34 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.647 0.737 . . . . 0.0 110.255 175.557 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3543 ' ' GLY . . . . . 0.805 ' HA3' ' HB2' ' A' 3539 ' ' PRO . . . -136.17 40.45 1.53 Allowed Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.069 178.092 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3544 ' ' GLY . . . . . 0.66 ' N ' ' HD2' ' A' 3545 ' ' PRO . . . -62.33 -41.01 99.76 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-O 118.901 -0.944 . . . . 0.0 113.881 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.66 ' HD2' ' N ' ' A' 3544 ' ' GLY . 2.3 Cg_endo -41.36 146.4 0.44 Allowed 'Trans proline' 0 C--N 1.362 1.252 0 C-N-CA 123.295 2.664 . . . . 0.0 112.692 174.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 32.0 Cg_exo -55.78 150.0 47.48 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.754 2.303 . . . . 0.0 112.68 -175.174 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.718 ' HB3' HD13 ' A' 3612 ' ' ILE . 22.5 mt -67.7 113.91 5.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.63 179.12 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.717 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -96.62 138.16 34.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.133 0.492 . . . . 0.0 112.028 -172.061 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.412 ' HB ' ' HB2' ' A' 3515 ' ' LEU . 19.4 mt -95.98 107.57 19.89 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-O 122.236 1.017 . . . . 0.0 111.694 -172.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.439 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.93 -2.61 13.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.054 -173.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.665 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 69.4 mt-30 -146.81 176.72 9.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.359 0.123 . . . . 0.0 110.872 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.8 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.45 140.58 12.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.952 0.406 . . . . 0.0 111.604 179.285 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.585 ' HB2' ' CD2' ' B' 2518 ' ' TYR . 14.8 tmm? -109.71 122.8 48.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.174 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3554 ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' 3554 ' ' ARG . 8.5 mmm180 -69.88 110.07 4.8 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 -177.081 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.517 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -73.52 98.3 2.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.281 1.039 . . . . 0.0 109.524 -177.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.616 ' O ' ' HG ' ' A' 3560 ' ' LEU . 34.2 mt-10 -111.49 171.67 7.34 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.67 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -57.54 -51.34 69.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.843 0.354 . . . . 0.0 111.041 -179.558 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 36.1 p -65.91 -32.81 74.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.387 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.583 ' O ' HG23 ' A' 3563 ' ' VAL . 12.1 mm100 -71.53 -40.54 70.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.093 179.252 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' 3556 ' ' GLU . 84.8 mt -60.06 -34.27 73.2 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.019 0.437 . . . . 0.0 110.109 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' 3557 ' ' ALA . 17.5 mm-40 -60.9 -49.74 76.24 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.119 173.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -65.02 -30.2 77.37 Favored Glycine 0 CA--C 1.52 0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.771 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.596 ' O ' ' HG3' ' A' 3567 ' ' MET . 59.8 t -66.71 -53.87 30.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 174.917 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3564 ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.22 -31.06 68.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.594 178.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -53.08 -51.82 60.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.691 176.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3566 ' ' ARG . . . . . 0.447 HH11 ' HD3' ' A' 3566 ' ' ARG . 14.0 ptt-85 -83.04 -9.28 59.33 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.093 0.473 . . . . 0.0 111.046 -178.266 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.596 ' HG3' ' O ' ' A' 3563 ' ' VAL . 81.2 mtp -84.5 -22.72 30.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.812 178.54 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 43.5 p -77.42 -5.73 50.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.035 0.445 . . . . 0.0 110.988 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 20.5 t -119.34 78.7 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.798 175.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.0 108.85 1.93 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.66 176.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.504 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 1.8 m 153.05 -41.73 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 O-C-N 124.921 1.388 . . . . 0.0 108.346 -176.117 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -84.96 -26.23 27.3 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.641 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.685 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -124.93 164.81 19.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.757 177.834 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.673 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 33.7 t -127.49 136.61 52.0 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 172.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.715 HD22 HD13 ' A' 3642 ' ' LEU . 13.0 tp -105.73 125.12 50.61 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.175 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.647 HD11 HD11 ' A' 3661 ' ' ILE . 67.7 mt -126.85 155.24 43.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.115 0.483 . . . . 0.0 111.035 -177.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.71 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -123.79 107.19 11.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.203 179.257 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.474 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.35 122.61 37.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.527 0.679 . . . . 0.0 110.488 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.504 HD21 HG22 ' A' 3650 ' ' ILE . 68.8 mt -122.88 147.58 51.53 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.658 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3580 ' ' PRO . . . . . 0.466 ' HA ' ' O ' ' A' 3521 ' ' ALA . 13.8 Cg_endo -57.42 125.47 18.93 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 122.096 1.864 . . . . 0.0 111.829 176.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 29.8 p -107.61 119.19 38.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.308 0.575 . . . . 0.0 110.164 178.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.49 146.08 16.13 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.769 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3583 ' ' ARG . . . . . 0.432 ' HG3' ' OD2' ' A' 3587 ' ' ASP . 35.6 mtp180 -69.97 -20.53 63.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.7 0.762 . . . . 0.0 108.946 173.92 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.599 ' O ' HG23 ' A' 3588 ' ' VAL . 9.7 t70 -154.26 169.55 23.39 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.553 -1.203 . . . . 0.0 107.876 -178.171 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -56.69 -44.69 81.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 118.165 0.439 . . . . 0.0 110.905 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.72 -35.51 80.8 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.484 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.457 ' HB3' ' H ' ' A' 3584 ' ' ASP . 20.3 t70 -68.02 -40.72 82.9 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.194 -178.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' 3584 ' ' ASP . 73.9 t -56.12 -45.15 80.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.511 177.023 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 85.6 t -55.78 -46.96 80.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.786 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 28.7 t -65.28 -43.79 90.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.026 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -64.24 -37.28 86.91 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.49 179.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 90.1 m -60.95 -54.96 38.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.612 177.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -65.54 -36.0 82.52 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.276 -177.13 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 20.9 t -65.32 -44.42 87.86 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.511 HD12 ' HB2' ' A' 3599 ' ' PHE . 58.7 tp -64.66 -45.96 84.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.119 -178.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.795 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.62 -29.3 69.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.324 -176.42 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -85.6 -41.05 15.59 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.245 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -86.87 -46.36 9.99 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -171.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.511 ' HB2' HD12 ' A' 3595 ' ' LEU . 11.2 m-85 -98.91 -50.74 4.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.806 0.336 . . . . 0.0 111.212 -175.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.795 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 24.8 mm -59.8 -54.55 33.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.978 -176.313 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3601 ' ' THR . . . . . 0.463 ' O ' ' HG3' ' A' 3604 ' ' GLN . 59.2 m -62.42 -38.4 89.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.431 -178.252 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 43.0 t80 -72.05 -54.32 10.2 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.116 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.532 HD12 ' O ' ' A' 3608 ' ' ALA . 0.4 OUTLIER -57.01 -38.78 73.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.794 179.85 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3604 ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' 3601 ' ' THR . 4.7 pp0? -72.29 -34.64 68.32 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.149 -179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -64.86 -36.98 86.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.874 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -84.1 -18.14 37.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.119 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 51.21 55.38 9.58 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -169.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.552 ' HB1' ' HB2' ' A' 3552 ' ' ARG . . . -135.21 -177.63 4.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.256 0.551 . . . . 0.0 112.113 -173.01 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.8 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.65 117.46 28.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.672 175.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -62.81 104.48 0.8 Allowed Glycine 0 C--O 1.224 -0.517 0 C-N-CA 120.751 -0.738 . . . . 0.0 111.365 178.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.665 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.5 mm -89.86 124.01 42.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.322 0.582 . . . . 0.0 110.884 -174.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.718 HD13 ' HB3' ' A' 3547 ' ' LEU . 45.7 mt -119.78 108.66 24.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.607 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.412 ' HA ' ' O ' ' A' 3624 ' ' TYR . 87.2 m-20 -85.22 121.17 27.58 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.67 -176.233 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.47 HG11 ' O ' ' A' 3537 ' ' SER . 48.4 t -105.88 124.96 34.4 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.983 -178.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.627 ' HA ' ' O ' ' A' 3621 ' ' GLN . 93.9 Cg_endo -90.99 138.22 2.34 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.687 2.258 . . . . 0.0 112.053 171.565 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.552 ' HB2' ' HB2' ' A' 3619 ' ' SER . 20.7 m120 -67.73 127.49 93.38 Favored Pre-proline 0 C--N 1.322 -0.623 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.035 178.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -52.05 114.9 1.83 Allowed 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 123.107 2.538 . . . . 0.0 112.432 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 96.63 -40.8 2.49 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.165 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3619 ' ' SER . . . . . 0.552 ' HB2' ' HB2' ' A' 3616 ' ' ASN . 44.3 m -81.55 -29.42 33.49 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.67 0.271 . . . . 0.0 110.935 -179.584 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3620 ' ' ASN . . . . . 0.465 ' O ' ' HD3' ' A' 3622 ' ' PRO . 3.9 m-20 61.72 28.19 17.35 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.673 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.627 ' O ' ' HA ' ' A' 3615 ' ' PRO . 5.9 tp-100 -89.46 106.81 15.01 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.059 178.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' 3620 ' ' ASN . 87.5 Cg_endo -80.5 26.6 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 123.436 2.757 . . . . 0.0 112.802 -178.289 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -75.76 34.93 0.12 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -175.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.54 ' HE2' HD21 ' A' 3616 ' ' ASN . 60.0 m-85 -128.49 133.95 48.6 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.487 174.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.497 HG13 HD12 ' A' 3611 ' ' ILE . 4.1 t -126.05 113.89 36.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.095 177.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.4 mp -98.84 112.46 24.55 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.479 ' O ' ' HA ' ' A' 3659 ' ' ILE . 33.9 mt-30 -95.14 111.15 23.01 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.9 -176.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.574 HG12 HG12 ' A' 3659 ' ' ILE . 39.9 mt -93.12 99.12 9.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.628 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -89.71 145.21 33.04 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.005 178.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.32 169.37 18.5 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.427 2.085 . . . . 0.0 111.243 173.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3631 ' ' PRO . . . . . 0.425 ' HD3' HD12 ' A' 3600 ' ' ILE . 57.0 Cg_endo -71.08 48.23 0.85 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.185 2.59 . . . . 0.0 112.576 178.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.9 p -74.72 163.4 27.73 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.374 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -47.43 -47.56 26.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.71 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 30.1 t80 -47.06 -48.11 22.52 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.414 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 20.6 t -59.26 -58.8 7.06 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.978 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -66.76 -35.22 79.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.336 -171.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 62.0 m -58.18 -57.77 11.39 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 120.867 0.365 . . . . 0.0 110.725 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3638 ' ' HIS . . . . . 0.491 ' CE1' HD11 ' A' 3575 ' ' LEU . 10.2 p80 -69.42 -26.14 64.47 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 120.145 -0.622 . . . . 0.0 110.721 -177.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 50.2 mt -64.42 -35.27 80.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.843 0.354 . . . . 0.0 110.375 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.948 ' HA ' HD22 ' A' 3647 ' ' LEU . 16.6 m -67.78 -39.01 84.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.232 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -78.18 -24.06 47.34 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.491 -177.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.715 HD13 HD22 ' A' 3575 ' ' LEU . 17.4 mt -101.13 -41.0 6.91 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -172.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.514 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -147.09 89.11 5.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.751 0.31 . . . . 0.0 111.687 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3644 ' ' PRO . . . . . 0.434 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 85.6 Cg_endo -78.14 -16.78 13.82 Favored 'Trans proline' 0 CA--C 1.534 0.475 0 C-N-CA 122.608 2.205 . . . . 0.0 113.974 -175.034 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 6.8 t0 -76.08 -53.4 8.39 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -177.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.71 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -73.13 -28.02 62.01 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 179.82 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.948 HD22 ' HA ' ' A' 3640 ' ' SER . 24.3 tp -52.15 -52.88 49.08 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.061 0.458 . . . . 0.0 111.04 175.328 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.23 -17.95 63.01 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.254 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.653 ' HB3' HG13 ' A' 3496 ' ' VAL . 11.0 m -87.39 -37.34 17.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.474 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.602 ' HA ' HG22 ' A' 3653 ' ' ILE . 3.5 pt -79.4 -12.13 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.863 0.363 . . . . 0.0 111.392 -178.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 19.7 m -55.05 -37.97 67.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.485 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 8.8 t30 -80.16 -33.5 38.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.841 0.353 . . . . 0.0 110.743 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.602 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.6 tp -104.01 39.67 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 122.585 1.184 . . . . 0.0 109.279 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.439 ' N ' ' HD2' ' A' 3655 ' ' PRO . 47.0 t -33.92 -46.03 0.63 Allowed Pre-proline 0 CA--C 1.541 0.604 0 CA-C-N 113.582 -1.644 . . . . 0.0 113.286 169.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.463 ' HG2' HD12 ' A' 3653 ' ' ILE . 19.8 Cg_endo -61.17 79.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.519 1.479 . . . . 0.0 111.776 170.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3656 ' ' HIS . . . . . 0.404 ' HB2' HD23 ' A' 3579 ' ' LEU . 31.5 p80 -143.78 170.31 16.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.999 -178.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.471 HD22 HG22 ' A' 3628 ' ' ILE . 69.2 mt -115.38 143.38 45.37 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.526 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 8.7 tmm? -110.48 111.26 22.39 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 177.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.796 HD12 HD21 ' A' 3524 ' ' LEU . 70.3 mt -107.95 122.52 62.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.652 -170.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.685 HG13 ' HD2' ' A' 3573 ' ' TYR . 72.3 t -106.27 116.47 50.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.005 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.673 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 54.0 mt -91.0 113.12 26.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.213 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.81 128.92 56.26 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.107 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 13.7 m -76.14 132.12 39.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.955 174.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.441 -0.79 . . . . 0.0 109.696 175.677 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.585 ' CD2' ' HB2' ' A' 3553 ' ' MET . 13.2 m-85 . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 120.36 0.124 . . . . 0.0 111.238 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.682 ' HG2' ' H ' ' B' 2520 ' ' THR . 14.5 tt0 55.09 -157.28 0.22 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.682 ' H ' ' HG2' ' B' 2519 ' ' GLU . 85.3 m -155.53 121.26 5.01 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 174.215 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.71 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.5 OUTLIER -79.58 -120.37 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.713 -179.414 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.697 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B 2523 ' ' ASP . . . . . 0.408 ' CG ' ' HB2' ' A' 3548 ' ' ARG . 8.6 t70 -149.94 -158.45 0.92 Allowed 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -178.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 30.3 tt0 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.318 -0.848 . . . . 0.0 109.814 179.023 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A 3496 ' ' VAL . . . . . 0.414 ' HB ' ' OG ' ' A' 3649 ' ' SER . 30.6 m . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 120.778 0.323 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 16.9 t70 -105.56 112.84 26.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.082 0.468 . . . . 0.0 110.523 -179.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 4.6 mpp? -81.9 -20.57 38.5 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.623 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.492 ' HA ' HD12 ' A' 3502 ' ' LEU . 34.6 t -62.62 -24.66 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.043 -177.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -74.97 -59.41 2.75 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.072 0.463 . . . . 0.0 110.865 173.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.567 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp -69.42 -32.51 71.53 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -169.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.614 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.17 -15.68 62.98 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.239 -173.852 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.614 ' N ' HD13 ' A' 3502 ' ' LEU . 49.6 tptt -67.05 -30.58 70.69 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 177.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 17.1 tptm -96.37 -39.68 9.49 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.399 178.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.688 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -151.4 106.97 2.94 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 121.454 0.645 . . . . 0.0 111.148 178.756 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 3506 ' ' PRO . . . . . 0.546 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 97.5 Cg_endo -86.35 174.41 6.05 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 124.184 3.256 . . . . 0.0 113.937 -177.747 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.507 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 94.4 mt -71.4 135.41 28.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.259 -178.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.521 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.4 m -102.46 -29.9 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.325 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.65 ' HB2' HD13 ' A' 3538 ' ' LEU . 39.9 t-105 -150.07 154.66 38.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.286 -178.32 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -150.52 119.14 6.51 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.3 -125.06 0.78 Allowed Glycine 0 N--CA 1.443 -0.881 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 -176.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.655 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.5 mp -141.44 158.57 43.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.087 0.47 . . . . 0.0 111.178 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.476 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 81.8 mt -113.24 150.25 32.64 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 169.152 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.591 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.21 125.62 13.97 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -177.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.596 HD12 HD21 ' B' 2521 ' ' LEU . 0.2 OUTLIER -138.39 138.71 38.5 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 171.944 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.576 ' HD2' ' HB3' ' B' 2522 ' ' SEP . 0.3 OUTLIER 59.97 -96.31 0.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.537 0.523 . . . . 0.0 110.122 -170.644 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -138.06 9.33 2.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.579 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.41 ' O ' ' HA ' ' A' 3514 ' ' ALA . 27.5 m-20 -100.28 125.71 46.51 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.857 -177.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' 3514 ' ' ALA . 38.6 p -117.73 134.83 54.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.563 177.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -129.86 122.51 28.81 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.655 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.67 119.42 17.87 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.076 0.465 . . . . 0.0 110.133 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.428 HG21 ' HG ' ' A' 3513 ' ' LEU . 35.0 m -130.44 147.98 33.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.596 0.712 . . . . 0.0 112.061 -175.55 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -108.89 126.02 52.62 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.043 172.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.825 HD21 HD12 ' A' 3659 ' ' ILE . 1.2 mt -94.83 110.31 22.19 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.736 -176.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.507 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 79.2 m-70 -86.71 138.96 31.21 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.03 -0.986 . . . . 0.0 108.878 176.166 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.688 ' O ' ' HB2' ' A' 3505 ' ' TYR . 69.1 t80 -68.99 137.91 54.1 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 173.589 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.584 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.3 t -114.61 -56.51 4.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 CA-C-O 121.474 0.654 . . . . 0.0 110.664 176.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.439 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 73.8 m -160.83 171.84 18.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.997 -172.081 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 90.12 -150.95 21.25 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.897 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.549 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.7 t-20 -101.53 111.73 24.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.955 0.407 . . . . 0.0 111.099 -177.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.2 p30 -62.31 -30.67 71.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.482 -177.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3532 ' ' VAL . . . . . 0.565 ' O ' ' HG2' ' A' 3536 ' ' ARG . 62.1 t -61.08 -35.57 66.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.491 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.434 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 29.7 mt -55.98 -40.45 73.31 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.929 177.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.405 ' HB1' ' CD1' ' A' 3538 ' ' LEU . . . -70.19 -37.14 75.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.994 0.426 . . . . 0.0 110.693 -179.504 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -61.5 -39.34 90.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.892 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.565 ' HG2' ' O ' ' A' 3532 ' ' VAL . 12.5 ptp180 -88.7 -21.39 23.91 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -177.196 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.527 ' HB2' HD11 ' A' 3626 ' ' LEU . 58.0 p -90.17 -43.31 10.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.71 0.291 . . . . 0.0 111.508 -178.268 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.65 HD13 ' HB2' ' A' 3509 ' ' TRP . 25.2 mt -78.65 113.59 36.14 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -174.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -78.18 146.51 22.64 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 123.174 2.583 . . . . 0.0 113.258 -170.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 1.5 pt? -165.37 169.53 15.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.061 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 23.0 t 175.26 -42.86 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 -178.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -151.74 136.68 17.26 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.642 175.679 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 63.56 -108.36 2.17 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.515 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -175.45 97.19 0.11 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.445 -0.662 . . . . 0.0 111.445 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -61.94 146.44 96.36 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 123.295 2.663 . . . . 0.0 112.723 -177.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.638 ' HA ' ' O ' ' A' 3512 ' ' LEU . 93.2 Cg_endo -84.23 126.48 3.74 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.676 2.251 . . . . 0.0 112.232 177.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.676 ' HB3' HD13 ' A' 3612 ' ' ILE . 28.6 mt -69.24 113.22 6.39 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.795 175.509 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.635 ' HD2' ' OD2' ' B' 2523 ' ' ASP . 40.4 ptt85 -91.41 135.76 33.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.936 0.398 . . . . 0.0 110.842 -175.12 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.677 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.2 mt -91.61 107.87 19.31 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-O 122.211 1.005 . . . . 0.0 111.021 -177.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.478 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -115.21 2.32 14.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.179 -0.918 . . . . 0.0 111.562 -175.012 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.698 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 73.9 mt-30 -151.54 171.94 16.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.581 0.229 . . . . 0.0 110.98 178.472 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.696 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.28 138.34 16.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.013 0.435 . . . . 0.0 111.322 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.718 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 17.9 ttt -109.49 124.88 51.81 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.467 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -65.75 110.79 2.94 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.37 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.57 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -75.13 97.95 3.58 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 122.32 1.057 . . . . 0.0 108.965 178.101 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.664 ' HB2' ' HG2' ' A' 3559 ' ' GLN . 58.2 mm-40 -113.18 165.43 12.41 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.821 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.498 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.31 -51.87 65.31 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.319 0.387 . . . . 0.0 111.098 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 41.5 p -62.09 -33.15 73.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.073 0.463 . . . . 0.0 110.908 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.664 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 32.1 mm-40 -73.88 -44.43 55.35 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.047 -176.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.542 HD21 ' HB2' ' A' 3555 ' ' LEU . 83.0 mt -64.11 -32.56 74.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.254 -176.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' 3557 ' ' ALA . 8.0 mm-40 -69.23 -44.02 72.84 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3562 ' ' GLY . . . . . 0.417 ' O ' ' HB3' ' A' 3565 ' ' ARG . . . -59.49 -40.03 95.7 Favored Glycine 0 CA--C 1.52 0.357 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.312 176.512 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' 3559 ' ' GLN . 62.7 t -62.51 -48.02 90.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 175.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3564 ' ' ALA . . . . . 0.538 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.44 -32.3 70.08 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.113 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.503 ' O ' HG22 ' A' 3568 ' ' THR . 43.4 ttm180 -57.82 -46.26 84.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.81 177.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -87.05 -5.32 59.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.936 0.398 . . . . 0.0 111.297 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.538 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 82.5 mtp -88.65 -21.12 24.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.959 176.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3568 ' ' THR . . . . . 0.503 HG22 ' O ' ' A' 3565 ' ' ARG . 3.3 t -74.59 -14.34 60.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.84 0.352 . . . . 0.0 111.186 -174.268 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 99.2 t -114.4 101.98 13.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.113 0.482 . . . . 0.0 110.412 178.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -73.99 108.32 6.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.549 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.5 m 151.47 -39.96 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.45 1.5 . . . . 0.0 108.082 -174.665 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -82.46 -26.37 32.71 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.523 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.732 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -135.36 169.06 18.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.294 179.061 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.62 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 34.5 t -130.1 136.56 49.46 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 171.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.781 HD22 HD13 ' A' 3642 ' ' LEU . 13.1 tp -106.54 125.98 51.69 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.667 HD11 HD11 ' A' 3661 ' ' ILE . 79.5 mt -127.53 157.05 41.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.175 0.512 . . . . 0.0 111.022 -177.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.616 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -124.03 109.43 13.51 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.173 179.079 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.472 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -95.1 123.36 38.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.277 0.561 . . . . 0.0 110.584 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.452 ' HG ' HD12 ' A' 3577 ' ' LEU . 69.0 mt -124.02 144.83 46.25 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.09 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.83 112.51 1.66 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.402 2.068 . . . . 0.0 111.955 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.9 p -96.74 108.31 20.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.222 0.534 . . . . 0.0 110.657 -177.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.06 146.79 16.67 Favored Glycine 0 N--CA 1.442 -0.93 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.059 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3583 ' ' ARG . . . . . 0.402 ' HG2' ' H ' ' A' 3583 ' ' ARG . 13.5 mmt180 -68.31 -36.68 79.68 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.682 0.753 . . . . 0.0 109.46 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.639 ' O ' HG23 ' A' 3588 ' ' VAL . 17.1 t70 -129.72 164.71 23.4 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.311 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3585 ' ' GLN . . . . . 0.44 ' O ' HG23 ' A' 3589 ' ' VAL . 23.7 tp60 -56.61 -39.39 73.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.887 0.375 . . . . 0.0 110.374 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -64.58 -44.89 89.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.144 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.49 ' HB3' ' H ' ' A' 3584 ' ' ASP . 30.0 t70 -60.59 -43.16 97.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.308 178.553 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.639 HG23 ' O ' ' A' 3584 ' ' ASP . 98.4 t -56.04 -47.99 79.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.215 177.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3589 ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' 3585 ' ' GLN . 80.4 t -60.06 -47.23 92.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.293 178.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 42.3 t -60.73 -42.06 96.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.061 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -69.55 -36.06 76.0 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.001 -0.279 . . . . 0.0 110.661 177.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 85.6 m -62.25 -53.17 58.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.697 178.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' 3596 ' ' LYS . 11.9 pt-20 -63.57 -34.15 77.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.18 -178.654 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.6 m -69.35 -46.12 67.77 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.884 0.374 . . . . 0.0 110.259 177.15 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.592 HD12 ' HB2' ' A' 3599 ' ' PHE . 63.9 tp -64.36 -43.55 94.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.958 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.811 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.1 OUTLIER -66.3 -32.87 74.54 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.958 -177.002 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.56 -37.58 22.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.795 0.331 . . . . 0.0 111.404 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.565 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -88.95 -45.91 9.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -172.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.72 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 19.7 m-85 -99.73 -50.08 4.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.671 0.272 . . . . 0.0 111.542 -176.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.811 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 24.0 mm -62.04 -60.28 2.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.131 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 91.2 m -56.96 -42.44 80.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.147 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.72 ' HD2' ' HA ' ' A' 3599 ' ' PHE . 0.0 OUTLIER -63.52 -53.37 52.99 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.542 0.211 . . . . 0.0 110.826 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.709 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -66.73 -36.22 81.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.916 0.389 . . . . 0.0 110.916 -170.916 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -73.87 -36.35 64.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.075 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -71.46 -34.56 70.32 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.786 0.327 . . . . 0.0 110.911 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3606 ' ' LYS . . . . . 0.586 ' HG2' ' O ' ' A' 3602 ' ' TYR . 66.5 mmtt -73.92 -18.17 60.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 177.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3607 ' ' GLN . . . . . 0.501 ' O ' ' HG ' ' A' 3555 ' ' LEU . 91.5 mt-30 55.05 43.61 29.44 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -172.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.578 ' HB1' ' HB2' ' A' 3552 ' ' ARG . . . -132.62 172.06 13.02 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.541 -170.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.718 ' HB3' ' HB3' ' A' 3553 ' ' MET . . . -107.95 118.67 37.35 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.354 172.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -63.01 103.6 0.67 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.211 177.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.698 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 32.7 mm -90.01 126.69 42.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 121.188 0.518 . . . . 0.0 110.924 -175.232 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.676 HD13 ' HB3' ' A' 3547 ' ' LEU . 39.7 mt -125.94 115.07 41.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.882 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3613 ' ' ASN . . . . . 0.435 ' HA ' ' O ' ' A' 3624 ' ' TYR . 77.6 m-20 -90.09 119.75 30.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.0 179.351 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.584 ' O ' ' HA ' ' A' 3622 ' ' PRO . 30.2 m -115.54 143.1 29.89 Favored Pre-proline 0 C--N 1.316 -0.859 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.863 -178.543 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.577 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 93.2 Cg_endo -91.72 137.12 1.87 Allowed 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 122.452 2.101 . . . . 0.0 112.48 174.402 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.58 ' ND2' ' HB2' ' A' 3619 ' ' SER . 56.1 t30 -95.15 106.25 24.56 Favored Pre-proline 0 C--N 1.315 -0.903 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 176.359 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -31.41 88.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 125.16 3.907 . . . . 0.0 115.083 -168.892 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 52.74 18.25 5.45 Favored Glycine 0 C--N 1.335 0.522 0 CA-C-N 115.411 -0.813 . . . . 0.0 114.126 177.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3619 ' ' SER . . . . . 0.58 ' HB2' ' ND2' ' A' 3616 ' ' ASN . 18.8 m -108.13 -35.86 6.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.315 0.558 . . . . 0.0 112.282 -175.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 63.7 t30 -153.36 13.82 0.5 Allowed 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.141 -0.623 . . . . 0.0 111.827 -174.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.77 ' HB3' ' HD2' ' A' 3622 ' ' PRO . 2.3 mp0 68.1 175.02 0.08 OUTLIER Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.822 174.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.77 ' HD2' ' HB3' ' A' 3621 ' ' GLN . 61.3 Cg_endo -73.96 25.46 0.33 Allowed 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 123.41 2.74 . . . . 0.0 113.921 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -76.51 43.73 0.33 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.957 0.408 . . . . 0.0 111.558 -178.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.512 ' OH ' ' HD3' ' A' 3536 ' ' ARG . 78.9 m-85 -128.63 132.83 48.15 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-O 121.031 0.443 . . . . 0.0 110.587 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.455 HG12 ' HG3' ' A' 3627 ' ' GLN . 5.7 t -119.37 114.7 45.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.99 178.501 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -96.27 110.93 23.15 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.307 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.478 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 18.3 mt-30 -94.44 110.43 22.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.826 -178.145 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.578 HG12 HG12 ' A' 3659 ' ' ILE . 35.6 mt -92.14 99.27 9.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.97 141.6 29.68 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.038 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.414 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 40.6 Cg_endo -67.33 165.39 27.07 Favored 'Trans proline' 0 CA--C 1.53 0.309 0 C-N-CA 122.591 2.194 . . . . 0.0 111.233 175.193 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -69.28 77.93 0.87 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.535 2.157 . . . . 0.0 111.876 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3632 ' ' CYS . . . . . 0.435 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.5 p -112.25 163.7 14.07 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.689 -174.745 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3633 ' ' GLU . . . . . 0.521 ' H ' ' CD ' ' A' 3633 ' ' GLU . 1.6 mp0 -46.47 -42.75 15.94 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.545 175.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 42.5 t80 -52.27 -52.12 54.55 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.451 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 55.1 p -69.69 -51.18 36.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.693 -177.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3636 ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' 3632 ' ' CYS . 13.3 mm-40 -60.35 -44.1 95.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.781 0.324 . . . . 0.0 111.361 -175.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 37.9 t -63.32 -39.51 94.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.192 0.52 . . . . 0.0 110.456 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 32.3 m80 -73.84 -33.07 63.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.66 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 75.8 mt -68.33 -37.22 80.34 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.407 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.474 ' CA ' ' HG ' ' A' 3647 ' ' LEU . 21.3 p -72.08 -31.1 65.78 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.255 0.55 . . . . 0.0 110.318 176.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3641 ' ' ARG . . . . . 0.489 ' CZ ' ' HA ' ' A' 3641 ' ' ARG . 1.2 tpm_? -76.04 -30.7 58.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.035 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.781 HD13 HD22 ' A' 3575 ' ' LEU . 16.4 mt -103.71 -32.65 9.27 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -172.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.433 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -148.7 72.74 10.59 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -175.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3644 ' ' PRO . . . . . 0.462 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 37.1 Cg_endo -65.57 -22.17 58.69 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 122.494 2.13 . . . . 0.0 111.764 179.341 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3645 ' ' ASP . . . . . 0.415 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 12.1 m-20 -70.1 -45.92 65.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.901 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.616 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -84.95 -30.74 24.04 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.575 176.73 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.474 ' HG ' ' CA ' ' A' 3640 ' ' SER . 3.4 tm? -54.19 -48.65 70.73 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.968 -179.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.66 -18.44 59.54 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.845 0.355 . . . . 0.0 111.67 -176.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3649 ' ' SER . . . . . 0.414 ' OG ' ' HB ' ' A' 3496 ' ' VAL . 6.4 t -89.73 -38.28 13.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.189 179.117 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.588 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.1 pt -76.59 -13.32 14.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -175.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.7 m -63.22 -17.65 62.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.953 0.406 . . . . 0.0 110.756 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 8.3 t30 -88.33 -36.71 16.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.171 0.51 . . . . 0.0 109.888 173.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.588 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -104.85 41.93 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-O 122.41 1.1 . . . . 0.0 109.327 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.449 ' N ' ' HD2' ' A' 3655 ' ' PRO . 66.5 m -33.47 -45.7 0.53 Allowed Pre-proline 0 CA--C 1.539 0.536 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.83 170.127 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.513 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.2 Cg_endo -59.4 84.42 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.511 1.474 . . . . 0.0 111.562 169.676 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -150.74 170.93 18.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.434 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.489 HD22 HG22 ' A' 3628 ' ' ILE . 43.8 mt -123.17 136.32 54.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.559 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 14.5 tmm? -102.7 111.81 24.3 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.825 HD12 HD21 ' A' 3524 ' ' LEU . 70.8 mt -107.31 119.74 57.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.276 0.56 . . . . 0.0 111.529 -170.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.732 HG13 ' HD2' ' A' 3573 ' ' TYR . 81.0 t -102.93 116.5 46.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.77 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.667 HD11 HD11 ' A' 3576 ' ' LEU . 55.1 mt -91.05 112.46 25.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 176.016 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -115.16 133.67 55.83 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.433 -177.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.9 m -67.82 110.05 3.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.7 171.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.25 1.084 0 C-N-CA 124.679 1.192 . . . . 0.0 112.75 -174.364 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.483 ' CD1' ' HB2' ' A' 3553 ' ' MET . 40.9 m-85 . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 119.833 -0.127 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.568 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.5 OUTLIER 54.54 -163.11 0.12 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.589 0.709 . . . . 0.0 111.948 178.237 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 10.8 p -145.47 116.15 7.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.413 167.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.677 HD22 ' CG2' ' A' 3549 ' ' ILE . 3.1 tp -76.72 -126.9 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.254 -178.331 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.576 ' HB3' ' HD2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B 2523 ' ' ASP . . . . . 0.635 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 9.1 t70 -176.91 -57.75 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.567 -175.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 14.9 tp10 . . . . . 0 C--O 1.246 0.898 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.689 174.347 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 3496 ' ' VAL . . . . . . . . . . . . . 20.6 m . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 120.891 0.377 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -65.19 112.74 3.56 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.188 0.518 . . . . 0.0 111.078 -176.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 71.2 mtm -76.12 -13.72 60.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.193 -179.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3499 ' ' VAL . . . . . 0.415 ' HA ' HD12 ' A' 3502 ' ' LEU . 51.3 t -62.82 -23.3 32.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.627 176.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -76.32 -59.15 2.89 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.205 0.526 . . . . 0.0 110.476 176.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3501 ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp -68.41 -32.88 73.25 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -170.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3502 ' ' LEU . . . . . 0.587 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -68.94 -14.79 63.25 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.339 -174.567 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 3503 ' ' LYS . . . . . 0.587 ' N ' HD13 ' A' 3502 ' ' LEU . 12.2 tmtt? -66.6 -28.99 68.94 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 176.065 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -99.78 -42.88 6.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.356 177.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3505 ' ' TYR . . . . . 0.701 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.17 99.16 3.7 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 121.481 0.657 . . . . 0.0 110.781 -179.703 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 3506 ' ' PRO . . . . . 0.541 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 60.1 Cg_endo -80.29 173.65 12.25 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 123.817 3.011 . . . . 0.0 113.504 -178.173 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3507 ' ' ILE . . . . . 0.487 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 74.8 mt -71.31 135.73 27.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.112 -176.01 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3508 ' ' VAL . . . . . 0.414 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.3 m -101.91 -29.14 3.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.408 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3509 ' ' TRP . . . . . 0.683 ' HB2' HD13 ' A' 3538 ' ' LEU . 74.7 t-105 -151.96 155.11 37.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.641 0.258 . . . . 0.0 110.717 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -148.13 118.93 7.56 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 176.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.86 -130.24 1.15 Allowed Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3512 ' ' LEU . . . . . 0.678 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -139.71 158.05 44.74 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.966 0.412 . . . . 0.0 110.803 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3513 ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' 3519 ' ' THR . 84.1 mt -110.47 149.65 30.0 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 170.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3514 ' ' ALA . . . . . 0.644 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.3 120.96 11.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -177.255 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3515 ' ' LEU . . . . . 0.709 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.27 145.75 41.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 172.935 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 3516 ' ' LYS . . . . . 0.709 ' HD3' HD12 ' A' 3515 ' ' LEU . 1.3 mptp? 63.64 -95.79 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -168.633 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -145.27 9.99 1.27 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.681 174.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3518 ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' A' 3514 ' ' ALA . 27.3 m-20 -97.28 129.12 44.62 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.423 -174.344 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3519 ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' 3514 ' ' ALA . 31.8 p -117.1 133.58 55.82 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.14 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -126.05 120.85 31.34 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3521 ' ' ALA . . . . . 0.678 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.17 120.64 18.06 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.086 0.47 . . . . 0.0 109.947 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3522 ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' 3579 ' ' LEU . 26.8 m -129.85 147.71 33.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.625 0.726 . . . . 0.0 111.822 -175.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -110.45 124.94 52.7 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.828 173.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3524 ' ' LEU . . . . . 0.796 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -94.17 109.96 21.72 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.597 -175.136 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 3525 ' ' HIS . . . . . 0.487 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 65.8 m80 -87.58 138.9 31.07 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.747 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3526 ' ' PHE . . . . . 0.701 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.2 t80 -67.56 136.41 54.47 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3527 ' ' VAL . . . . . 0.581 ' CG1' HD23 ' A' 3575 ' ' LEU . 26.1 t -114.68 -55.39 4.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 121.254 0.549 . . . . 0.0 110.765 176.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3528 ' ' SER . . . . . 0.5 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 72.9 m -162.01 172.53 15.8 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.948 -172.435 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.74 -152.21 22.29 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.338 -0.934 . . . . 0.0 112.166 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3530 ' ' ASN . . . . . 0.573 ' HB2' ' HA ' ' A' 3571 ' ' THR . 50.2 t30 -108.34 119.26 38.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.889 0.376 . . . . 0.0 110.463 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -63.41 -27.5 69.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.691 -177.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3532 ' ' VAL . . . . . 0.405 ' HB ' ' ND2' ' A' 3530 ' ' ASN . 62.4 t -57.86 -32.79 44.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.033 0.444 . . . . 0.0 110.649 178.467 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3533 ' ' LEU . . . . . 0.539 HD23 ' HD3' ' A' 3536 ' ' ARG . 28.3 mt -62.12 -40.61 96.5 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.367 178.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3534 ' ' ALA . . . . . 0.485 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.5 -41.86 92.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.954 0.407 . . . . 0.0 110.195 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -61.03 -37.15 81.58 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.936 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3536 ' ' ARG . . . . . 0.539 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.6 ptm180 -89.78 -7.98 53.18 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.132 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3537 ' ' SER . . . . . 0.496 ' HB2' HD11 ' A' 3626 ' ' LEU . 41.1 p -105.14 -40.5 5.85 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.783 0.325 . . . . 0.0 111.621 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3538 ' ' LEU . . . . . 0.683 HD13 ' HB2' ' A' 3509 ' ' TRP . 28.2 mt -79.14 110.3 14.31 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-O 121.281 0.562 . . . . 0.0 109.708 -173.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.18 147.63 18.6 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 123.123 2.548 . . . . 0.0 113.273 -170.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3540 ' ' LEU . . . . . 0.53 ' HB3' ' CH2' ' A' 3509 ' ' TRP . 4.4 pp -137.81 162.15 34.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.932 177.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 41.2 t -178.63 -45.26 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.313 0.577 . . . . 0.0 109.584 -175.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -138.94 96.25 3.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.203 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 64.53 -90.52 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.543 -175.443 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -152.77 95.57 0.16 Allowed Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 111.004 -0.838 . . . . 0.0 111.004 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3545 ' ' PRO . . . . . 0.45 ' CD ' ' HA ' ' A' 3540 ' ' LEU . 31.9 Cg_exo -60.12 149.29 85.67 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 123.426 2.75 . . . . 0.0 113.144 -176.739 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3546 ' ' PRO . . . . . 0.583 ' HA ' ' O ' ' A' 3512 ' ' LEU . 87.4 Cg_endo -80.71 141.37 13.62 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.761 2.308 . . . . 0.0 112.733 179.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3547 ' ' LEU . . . . . 0.672 ' HB3' HD13 ' A' 3612 ' ' ILE . 30.3 mt -85.95 115.24 23.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.131 176.13 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3548 ' ' ARG . . . . . 0.644 ' HA ' ' O ' ' A' 3514 ' ' ALA . 37.7 ptt85 -91.35 140.76 29.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.19 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3549 ' ' ILE . . . . . 0.549 ' CG2' HD22 ' B' 2521 ' ' LEU . 17.3 mt -96.14 107.26 19.45 Favored 'Isoleucine or valine' 0 C--O 1.249 1.045 0 CA-C-O 122.5 1.143 . . . . 0.0 111.458 -177.364 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3550 ' ' ALA . . . . . 0.56 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -114.94 4.63 14.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.92 -172.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3551 ' ' GLN . . . . . 0.731 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 62.6 mt-30 -155.0 167.22 31.08 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.469 0.308 . . . . 0.0 110.804 177.109 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3552 ' ' ARG . . . . . 0.686 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -149.03 134.04 18.11 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.072 0.463 . . . . 0.0 111.228 177.508 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 3553 ' ' MET . . . . . 0.623 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 14.6 tmm? -108.76 116.34 31.79 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.329 178.609 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -65.25 110.24 2.51 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3555 ' ' LEU . . . . . 0.637 ' O ' HD12 ' A' 3555 ' ' LEU . 2.1 pp -69.67 98.71 1.21 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.053 0.93 . . . . 0.0 110.233 -175.345 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3556 ' ' GLU . . . . . 0.627 ' O ' ' HG ' ' A' 3560 ' ' LEU . 37.4 mt-10 -107.67 167.11 10.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.567 177.047 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3557 ' ' ALA . . . . . 0.515 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -57.71 -48.19 80.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.902 0.382 . . . . 0.0 110.238 178.799 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 1.7 p -62.29 -34.01 75.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.715 178.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3559 ' ' GLN . . . . . 0.551 ' O ' HG23 ' A' 3563 ' ' VAL . 86.8 mm-40 -74.38 -40.04 62.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.868 -179.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3560 ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' 3556 ' ' GLU . 74.9 mt -63.98 -34.18 77.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.4 179.093 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3561 ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.1 mm-40 -61.71 -45.6 93.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.13 0.49 . . . . 0.0 109.982 174.041 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -58.06 -44.96 94.43 Favored Glycine 0 N--CA 1.453 -0.186 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.214 175.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3563 ' ' VAL . . . . . 0.617 ' O ' ' HG3' ' A' 3567 ' ' MET . 40.2 t -61.83 -50.52 79.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.823 0.344 . . . . 0.0 110.28 177.009 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3564 ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.45 -31.89 68.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.695 -178.556 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3565 ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' 3568 ' ' THR . 31.6 ttp85 -54.3 -46.21 72.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.745 178.221 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3566 ' ' ARG . . . . . 0.428 ' HG2' ' O ' ' A' 3563 ' ' VAL . 16.9 ptt-85 -86.63 -12.74 47.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.872 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3567 ' ' MET . . . . . 0.617 ' HG3' ' O ' ' A' 3563 ' ' VAL . 86.3 mtp -78.25 -27.02 47.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 110.742 178.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3568 ' ' THR . . . . . 0.489 HG22 ' O ' ' A' 3565 ' ' ARG . 7.7 t -82.91 1.34 39.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.197 0.522 . . . . 0.0 110.276 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 51.7 t -128.42 87.41 1.08 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.689 176.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -70.4 109.21 4.63 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3571 ' ' THR . . . . . 0.573 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.4 m 151.17 -38.53 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.418 1.487 . . . . 0.0 108.438 -176.404 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -82.36 -29.98 30.62 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.263 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3573 ' ' TYR . . . . . 0.739 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -127.25 163.55 23.68 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.873 176.249 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 3574 ' ' CYS . . . . . 0.614 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 28.0 t -128.25 136.48 51.09 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 171.632 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3575 ' ' LEU . . . . . 0.753 HD22 HD13 ' A' 3642 ' ' LEU . 13.1 tp -106.06 125.61 51.2 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3576 ' ' LEU . . . . . 0.605 HD11 HD11 ' A' 3661 ' ' ILE . 79.7 mt -127.61 155.58 43.63 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.138 0.494 . . . . 0.0 110.825 -177.363 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3577 ' ' LEU . . . . . 0.706 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -123.03 107.9 12.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.387 179.776 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 3578 ' ' ALA . . . . . 0.492 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.27 123.53 37.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.325 0.584 . . . . 0.0 110.501 -177.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3579 ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' 3522 ' ' VAL . 53.6 mt -124.29 144.24 45.13 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 114.97 -1.013 . . . . 0.0 110.328 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3580 ' ' PRO . . . . . 0.406 ' HA ' ' O ' ' A' 3521 ' ' ALA . 18.2 Cg_endo -60.57 113.06 1.53 Allowed 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.37 2.047 . . . . 0.0 111.452 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.2 p -99.28 107.79 20.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.349 0.595 . . . . 0.0 110.362 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3582 ' ' GLY . . . . . 0.439 ' HA2' ' OD2' ' A' 3587 ' ' ASP . . . -98.28 145.6 17.83 Favored Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.563 179.432 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3583 ' ' ARG . . . . . 0.404 ' HG2' ' OD2' ' A' 3587 ' ' ASP . 27.2 mmt-85 -64.4 -43.04 95.67 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3584 ' ' ASP . . . . . 0.612 ' O ' HG23 ' A' 3588 ' ' VAL . 5.3 p-10 -134.65 -179.77 5.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.096 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -57.7 -43.6 85.28 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.102 0.251 . . . . 0.0 111.336 -175.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.33 -43.85 89.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.345 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3587 ' ' ASP . . . . . 0.439 ' OD2' ' HA2' ' A' 3582 ' ' GLY . 26.8 t70 -60.84 -44.67 96.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.398 -179.172 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3588 ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' 3584 ' ' ASP . 98.4 t -56.52 -39.82 64.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.71 178.396 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3589 ' ' VAL . . . . . 0.442 ' O ' ' HG2' ' A' 3593 ' ' GLU . 13.1 t -64.87 -51.1 71.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.582 0.706 . . . . 0.0 109.641 -179.201 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 34.3 m -64.32 -37.99 89.46 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.196 -177.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -71.42 -37.17 71.48 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.128 -0.358 . . . . 0.0 111.061 177.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 89.2 m -63.32 -50.07 71.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.644 0.259 . . . . 0.0 110.818 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3593 ' ' GLU . . . . . 0.547 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 8.8 pt-20 -64.2 -37.11 86.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.97 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 7.6 t -67.52 -43.12 81.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.822 0.344 . . . . 0.0 110.232 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3595 ' ' LEU . . . . . 0.56 HD12 ' HB2' ' A' 3599 ' ' PHE . 61.4 tp -63.42 -46.63 85.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.101 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3596 ' ' LYS . . . . . 0.832 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 57.5 pttt -67.84 -30.58 70.01 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.008 -177.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.78 -38.44 54.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.729 0.299 . . . . 0.0 111.57 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3598 ' ' ALA . . . . . 0.407 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -93.91 -45.93 7.4 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -171.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3599 ' ' PHE . . . . . 0.56 ' HB2' HD12 ' A' 3595 ' ' LEU . 12.0 m-85 -98.97 -50.07 4.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.651 0.262 . . . . 0.0 111.683 -175.014 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3600 ' ' ILE . . . . . 0.832 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.6 mm -61.88 -60.08 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.261 -175.597 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 74.8 m -53.29 -40.92 65.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.675 0.274 . . . . 0.0 111.089 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3602 ' ' TYR . . . . . 0.78 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -64.71 -57.07 9.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.082 179.503 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 3603 ' ' LEU . . . . . 0.78 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.1 OUTLIER -57.99 -41.62 83.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.644 0.259 . . . . 0.0 111.43 -177.89 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -72.66 -36.09 67.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.567 -176.736 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.74 68.44 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.942 0.401 . . . . 0.0 110.961 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -81.2 -19.1 44.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.78 177.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3607 ' ' GLN . . . . . 0.551 ' O ' ' HG ' ' A' 3555 ' ' LEU . 46.3 mt-30 50.39 52.06 15.57 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -171.003 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3608 ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' 3603 ' ' LEU . . . -135.45 -176.19 4.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.193 -171.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3609 ' ' ALA . . . . . 0.686 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.4 117.97 29.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.537 176.452 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -65.24 102.4 0.66 Allowed Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.244 -0.742 . . . . 0.0 111.244 177.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3611 ' ' ILE . . . . . 0.731 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 32.4 mm -89.3 126.18 42.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-O 121.201 0.525 . . . . 0.0 110.762 -175.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3612 ' ' ILE . . . . . 0.672 HD13 ' HB3' ' A' 3547 ' ' LEU . 34.1 mt -122.07 112.92 36.74 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.221 177.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -84.64 111.7 19.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.121 -179.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3614 ' ' VAL . . . . . 0.547 ' O ' ' HA ' ' A' 3622 ' ' PRO . 34.8 m -109.47 144.66 30.29 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.662 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3615 ' ' PRO . . . . . 0.492 ' HA ' ' O ' ' A' 3621 ' ' GLN . 97.7 Cg_endo -92.68 140.46 1.96 Allowed 'Trans proline' 0 N--CA 1.444 -1.398 0 C-N-CA 122.4 2.067 . . . . 0.0 112.118 173.381 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3616 ' ' ASN . . . . . 0.504 ' HB2' ' CE2' ' A' 3624 ' ' TYR . 7.7 t30 -79.8 118.92 74.9 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.4 178.136 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -50.72 124.96 14.56 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 123.011 2.474 . . . . 0.0 112.103 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 106.47 -50.13 0.83 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.917 -0.658 . . . . 0.0 111.719 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 15.3 m -91.37 -29.06 17.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.175 0.512 . . . . 0.0 110.144 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 3.2 m-20 62.63 17.71 9.93 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.018 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3621 ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' A' 3615 ' ' PRO . 78.6 mt-30 -82.53 120.3 76.42 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.028 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3622 ' ' PRO . . . . . 0.547 ' HA ' ' O ' ' A' 3614 ' ' VAL . 91.4 Cg_endo -80.8 24.79 0.65 Allowed 'Trans proline' 0 C--O 1.233 0.253 0 C-N-CA 123.405 2.736 . . . . 0.0 112.444 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -77.77 44.54 0.46 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.175 0.512 . . . . 0.0 111.651 -176.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3624 ' ' TYR . . . . . 0.504 ' CE2' ' HB2' ' A' 3616 ' ' ASN . 80.7 m-85 -134.82 133.04 39.35 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.962 177.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3625 ' ' VAL . . . . . 0.455 HG13 HG23 ' A' 3611 ' ' ILE . 3.1 t -118.97 115.57 48.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.067 179.262 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3626 ' ' LEU . . . . . 0.629 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -97.82 113.79 25.68 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 169.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3627 ' ' GLN . . . . . 0.575 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 95.0 mt-30 -94.48 111.42 23.17 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.225 -178.26 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3628 ' ' ILE . . . . . 0.595 HG12 HG12 ' A' 3659 ' ' ILE . 40.9 mt -92.08 98.22 8.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.034 178.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -88.96 141.94 29.94 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.855 178.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3630 ' ' PRO . . . . . 0.604 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.6 Cg_endo -70.83 169.24 20.75 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 122.487 2.125 . . . . 0.0 111.414 176.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -68.0 74.31 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.684 2.256 . . . . 0.0 111.833 176.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3632 ' ' CYS . . . . . 0.587 ' O ' ' HG2' ' A' 3636 ' ' GLU . 9.0 p -111.69 163.34 14.23 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.642 -174.431 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -47.69 -41.66 23.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.738 177.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 39.1 t80 -53.91 -52.42 60.59 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.441 177.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 56.4 p -70.29 -53.55 16.38 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.686 -177.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3636 ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.1 mm-40 -56.21 -44.76 79.82 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 123.445 0.466 . . . . 0.0 111.072 -174.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 48.4 t -61.97 -53.11 60.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.565 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 43.2 m80 -61.62 -34.86 76.4 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.573 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.55 -31.3 71.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.315 177.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3640 ' ' SER . . . . . 0.635 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 21.8 m -71.16 -29.91 65.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.33 0.586 . . . . 0.0 110.035 -178.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -89.05 -44.57 10.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.424 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3642 ' ' LEU . . . . . 0.753 HD13 HD22 ' A' 3575 ' ' LEU . 22.8 mt -78.48 -30.85 47.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.246 -0.434 . . . . 0.0 112.17 -173.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3643 ' ' ALA . . . . . 0.459 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -150.78 69.54 8.55 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.456 0.17 . . . . 0.0 111.369 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.0 -19.39 66.4 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.417 2.078 . . . . 0.0 111.731 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3645 ' ' ASP . . . . . 0.447 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 18.1 m-20 -72.83 -51.42 18.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.204 -177.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3646 ' ' LEU . . . . . 0.706 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -79.5 -29.94 41.77 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.183 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 3647 ' ' LEU . . . . . 0.635 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -54.26 -45.72 72.48 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.424 178.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.32 -31.13 69.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.96 0.409 . . . . 0.0 111.119 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 15.3 m -76.78 -36.56 56.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.852 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3650 ' ' ILE . . . . . 0.761 ' HA ' HG22 ' A' 3653 ' ' ILE . 7.0 pt -83.5 -9.89 11.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.925 0.393 . . . . 0.0 111.293 -176.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 8.3 t -60.18 -25.53 65.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.329 176.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 17.9 m120 -88.01 -32.56 18.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.033 0.444 . . . . 0.0 110.305 175.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3653 ' ' ILE . . . . . 0.761 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.4 OUTLIER -104.68 36.1 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-O 122.847 1.308 . . . . 0.0 109.16 -177.121 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A 3654 ' ' SER . . . . . 0.428 ' N ' ' HD2' ' A' 3655 ' ' PRO . 49.5 m -30.31 -45.61 0.26 Allowed Pre-proline 0 N--CA 1.473 0.701 0 CA-C-N 113.966 -1.47 . . . . 0.0 114.433 172.182 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3655 ' ' PRO . . . . . 0.547 ' HG2' HD13 ' A' 3653 ' ' ILE . 11.9 Cg_endo -58.28 80.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 121.826 1.684 . . . . 0.0 111.842 169.287 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -146.91 169.39 19.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.762 -176.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3657 ' ' LEU . . . . . 0.492 HD22 HG22 ' A' 3628 ' ' ILE . 50.3 mt -121.64 137.15 54.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.656 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.3 tmm? -104.39 112.55 25.64 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3659 ' ' ILE . . . . . 0.796 HD12 HD21 ' A' 3524 ' ' LEU . 73.1 mt -106.62 121.27 59.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.237 0.542 . . . . 0.0 111.59 -171.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3660 ' ' VAL . . . . . 0.739 HG13 ' HD2' ' A' 3573 ' ' TYR . 79.5 t -104.47 116.43 48.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.914 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3661 ' ' ILE . . . . . 0.629 HG12 ' HG ' ' A' 3626 ' ' LEU . 73.4 mt -91.07 115.72 30.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 176.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -122.96 133.58 54.37 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.226 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.1 m -78.49 110.19 13.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A 3664 ' ' VAL . . . . . 0.432 HG11 HG23 ' A' 3625 ' ' VAL . 3.4 p . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.921 -1.038 . . . . 0.0 111.262 -175.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 2518 ' ' TYR . . . . . 0.575 ' CD1' ' HB2' ' A' 3553 ' ' MET . 7.6 m-85 . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 119.17 -0.443 . . . . 0.0 112.144 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 2519 ' ' GLU . . . . . 0.552 ' HG2' ' HE ' ' A' 3552 ' ' ARG . 30.6 tt0 44.49 95.94 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 172.092 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 2520 ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' 3550 ' ' ALA . 17.5 p -57.64 131.12 49.29 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 122.291 -0.256 . . . . 0.0 111.189 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 2521 ' ' LEU . . . . . 0.654 ' HG ' ' N ' ' B' 2522 ' ' SEP . 16.7 tp -81.98 -118.36 0.02 OUTLIER 'General case' 0 C--O 1.234 0.238 0 C-N-CA 121.178 -0.209 . . . . 0.0 110.558 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 2522 ' ' SEP . . . . . 0.654 ' N ' ' HG ' ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B 2523 ' ' ASP . . . . . 0.591 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 6.1 t70 -146.01 -65.63 0.3 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.886 178.153 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 . . . . . 0 C--O 1.247 0.966 0 CA-C-O 118.694 -0.669 . . . . 0.0 109.868 175.495 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.61 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.0 pp . . . . . 0 N--CA 1.451 -0.376 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.619 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.25 -16.23 63.01 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.234 -174.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.619 ' N ' HD13 ' A' 3502 ' ' LEU . 73.6 mmtt -72.0 -25.05 61.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.312 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 85.3 mttt -104.41 -44.53 4.9 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.507 0.67 . . . . 0.0 110.511 177.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.756 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -142.47 94.33 6.81 Favored Pre-proline 0 N--CA 1.435 -1.191 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.192 -176.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -80.64 174.17 11.41 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 123.811 3.007 . . . . 0.0 113.432 -178.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.461 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.2 mt -70.57 136.81 25.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.792 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 28.6 m -108.02 -20.33 6.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.699 -177.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.788 ' HE3' HD12 ' A' 3524 ' ' LEU . 24.2 t90 -159.69 153.16 22.45 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.643 0.259 . . . . 0.0 110.388 -176.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -148.27 119.9 8.02 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 177.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -172.91 -129.65 1.17 Allowed Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.743 -0.741 . . . . 0.0 111.515 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.646 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -140.01 155.86 46.89 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.073 0.463 . . . . 0.0 111.196 -179.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.524 HD23 ' HB2' ' A' 3547 ' ' LEU . 83.2 mt -107.63 152.43 24.3 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 168.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.636 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -146.86 122.47 10.46 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.598 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.89 145.21 41.86 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 171.6 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.598 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.1 OUTLIER 59.83 -96.16 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.989 0.423 . . . . 0.0 110.069 -168.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -143.68 8.49 1.52 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -102.35 122.42 44.22 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.14 -173.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 66.6 p -108.62 152.7 24.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.104 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -141.61 114.75 8.71 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.193 173.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.646 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -69.01 117.2 10.36 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 176.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.421 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.9 m -131.31 148.16 32.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.426 -177.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -112.57 132.88 54.91 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.042 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.891 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -100.64 113.11 25.67 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.408 0.623 . . . . 0.0 112.189 -173.087 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.461 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 83.0 m-70 -87.32 137.56 32.24 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.481 174.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.756 ' O ' ' HB2' ' A' 3505 ' ' TYR . 62.1 t80 -66.14 139.83 58.17 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 174.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.604 ' CG1' HD23 ' A' 3575 ' ' LEU . 16.2 t -116.62 -55.64 4.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.362 0.601 . . . . 0.0 111.304 175.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.426 ' HB3' ' HB3' ' A' 3575 ' ' LEU . 13.6 t -158.02 170.14 22.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.917 -169.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.03 -152.23 24.43 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.86 175.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.434 ' HB2' ' HA ' ' A' 3571 ' ' THR . 52.2 t-20 -97.95 114.58 26.73 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -64.21 -28.22 69.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.73 0.3 . . . . 0.0 111.356 -177.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 60.9 t -64.84 -31.12 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.827 0.346 . . . . 0.0 110.442 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.521 HD23 ' HD3' ' A' 3536 ' ' ARG . 18.5 mt -57.31 -39.0 74.91 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.91 176.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.458 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -70.83 -44.62 66.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.852 0.358 . . . . 0.0 110.498 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 59.0 t60 -60.76 -32.51 71.81 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.023 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.521 ' HD3' HD23 ' A' 3533 ' ' LEU . 14.1 ptm180 -89.07 -18.27 27.62 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -177.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.483 ' HB2' HG21 ' A' 3614 ' ' VAL . 42.3 p -98.66 -39.07 8.86 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 122.128 -0.357 . . . . 0.0 111.428 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.689 HD13 ' HB2' ' A' 3509 ' ' TRP . 30.6 mt -80.27 110.69 17.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.272 -174.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo . . . . . 0 N--CA 1.462 -0.325 0 C-N-CA 123.351 2.701 . . . . 0.0 112.882 -172.185 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . 0.596 ' HA ' ' O ' ' A' 3512 ' ' LEU . 15.9 Cg_endo . . . . . 0 C--O 1.234 0.289 0 CA-C-O 121.052 0.355 . . . . 0.0 112.799 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.706 ' HB3' HD13 ' A' 3612 ' ' ILE . 29.4 mt -68.92 116.4 9.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.333 177.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.636 ' HA ' ' O ' ' A' 3514 ' ' ALA . 16.9 ptt180 -90.35 139.07 31.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.36 -175.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.488 HD12 HD22 ' A' 3515 ' ' LEU . 31.7 mt -93.1 105.86 17.28 Favored 'Isoleucine or valine' 0 C--O 1.242 0.688 0 CA-C-O 122.066 0.936 . . . . 0.0 110.555 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -103.84 -14.56 15.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.45 -171.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.689 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 96.1 mt-30 -146.78 177.65 8.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.697 -177.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.738 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -152.82 140.95 20.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 0.0 111.689 -178.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.658 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 17.2 ttt -111.41 110.48 20.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.727 176.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -61.67 110.7 1.58 Allowed 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.505 ' O ' HD12 ' A' 3555 ' ' LEU . 2.4 pp -75.2 98.82 3.84 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.007 0.908 . . . . 0.0 110.023 -176.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.707 ' O ' ' HG ' ' A' 3560 ' ' LEU . 33.6 mt-10 -101.54 162.59 12.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.122 174.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.502 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -59.9 -38.02 81.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.138 0.494 . . . . 0.0 109.805 177.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 3.1 p -66.98 -41.08 87.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.162 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.676 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 77.6 mm-40 -63.68 -42.93 97.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.068 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.707 ' HG ' ' O ' ' A' 3556 ' ' GLU . 78.2 mt -60.83 -32.93 72.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.315 -178.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.631 ' O ' ' HD3' ' A' 3565 ' ' ARG . 10.9 mm-40 -60.95 -50.78 71.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.211 0.529 . . . . 0.0 109.72 173.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.28 -41.48 99.52 Favored Glycine 0 N--CA 1.452 -0.248 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.067 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' 3559 ' ' GLN . 69.3 t -60.47 -48.28 89.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 176.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.69 76.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.247 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.631 ' HD3' ' O ' ' A' 3561 ' ' GLU . 5.1 mpt_? -59.45 -41.73 90.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.236 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 24.7 ptt180 -88.2 -9.93 51.47 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.724 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.514 ' HG3' ' O ' ' A' 3563 ' ' VAL . 84.5 mtp -83.22 -29.41 28.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.939 0.4 . . . . 0.0 110.531 176.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . 0.486 HG22 ' O ' ' A' 3565 ' ' ARG . 7.0 t -75.41 -15.1 60.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.065 0.46 . . . . 0.0 110.228 -178.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 46.0 t -103.12 87.0 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.958 177.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.4 107.64 6.68 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.434 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.1 m 155.68 -42.11 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 125.227 1.411 . . . . 0.0 107.662 -172.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.03 -30.91 31.23 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.48 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.854 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -126.67 164.03 22.19 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.201 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.615 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 38.3 t -127.59 135.59 50.49 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 171.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.789 HD22 HD13 ' A' 3642 ' ' LEU . 12.8 tp -106.27 125.8 51.44 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.613 HD11 HD11 ' A' 3661 ' ' ILE . 79.4 mt -127.59 154.66 44.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.158 0.504 . . . . 0.0 110.693 -177.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.699 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -119.75 109.76 15.99 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.135 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.527 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.55 119.74 33.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.366 0.603 . . . . 0.0 110.391 -179.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.492 ' HG ' HD12 ' A' 3577 ' ' LEU . 59.0 mt -119.4 142.92 33.4 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 114.721 -1.127 . . . . 0.0 109.987 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.65 113.35 1.52 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.437 2.091 . . . . 0.0 111.612 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.5 p -96.38 106.01 18.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.483 0.659 . . . . 0.0 110.448 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -102.09 147.72 17.42 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.652 178.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 48.1 ttp180 -58.75 -43.47 90.3 Favored 'General case' 0 N--CA 1.428 -1.558 0 CA-C-O 121.371 0.605 . . . . 0.0 110.421 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.631 ' O ' HG23 ' A' 3588 ' ' VAL . 3.9 p30 -142.23 177.77 8.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.012 -0.995 . . . . 0.0 108.97 178.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . 0.418 ' O ' HG23 ' A' 3589 ' ' VAL . 64.4 tt0 -51.93 -46.36 64.64 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.512 0.508 . . . . 0.0 111.53 -176.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -62.57 -46.66 87.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.409 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 22.8 t70 -60.54 -41.43 94.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.06 0.457 . . . . 0.0 110.632 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' 3584 ' ' ASP . 96.1 t -57.54 -45.27 86.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.574 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' 3585 ' ' GLN . 83.0 t -57.76 -46.16 86.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.697 178.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 14.3 t -64.09 -42.88 96.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.724 -178.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . 0.581 ' NE2' ' H ' ' A' 3521 ' ' ALA . 13.4 mm100 -65.22 -39.94 93.44 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.628 178.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . 0.431 ' O ' ' HG3' ' A' 3596 ' ' LYS . 31.6 m -61.85 -45.43 93.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.082 177.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -59.77 -50.09 75.18 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.921 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 61.3 m -61.08 -45.24 95.53 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.936 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.541 HD12 ' HB2' ' A' 3599 ' ' PHE . 44.8 tp -61.71 -45.33 94.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.072 -177.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.602 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 51.8 mtmt -57.95 -44.95 87.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.085 -179.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.88 -38.32 53.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.906 -175.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -89.69 -46.96 8.25 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -170.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.541 ' HB2' HD12 ' A' 3595 ' ' LEU . 22.9 m-85 -100.24 -50.84 3.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.721 0.296 . . . . 0.0 111.505 -175.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.602 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 32.4 mm -60.67 -58.91 5.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.841 -175.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 87.0 m -60.12 -42.57 95.06 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.363 -178.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.496 ' HE1' HD11 ' B' 2521 ' ' LEU . 40.4 t80 -65.3 -53.59 41.72 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.044 -178.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.535 HD12 ' O ' ' A' 3608 ' ' ALA . 0.3 OUTLIER -61.74 -37.15 83.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.568 0.223 . . . . 0.0 111.457 -176.599 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -76.73 -30.71 56.72 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -66.78 -36.24 81.94 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.164 0.506 . . . . 0.0 110.427 176.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -82.1 -18.49 42.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.589 178.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 50.05 54.52 10.94 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -168.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.535 ' O ' HD12 ' A' 3603 ' ' LEU . . . -136.05 -177.79 4.85 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.857 -172.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.738 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -116.67 120.2 37.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.959 176.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . 0.465 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.19 103.64 0.76 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 176.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.689 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 34.1 mm -89.36 117.84 33.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.239 0.542 . . . . 0.0 110.647 -174.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.706 HD13 ' HB3' ' A' 3547 ' ' LEU . 17.5 mt -113.74 117.2 54.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.225 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.508 ' HA ' ' O ' ' A' 3624 ' ' TYR . 10.0 m120 -92.38 117.42 29.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.758 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.483 HG21 ' HB2' ' A' 3537 ' ' SER . 31.5 m . . . . . 0 C--N 1.32 -0.712 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.249 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.508 ' O ' ' HA ' ' A' 3613 ' ' ASN . 38.5 m-85 . . . . . 0 CA--C 1.508 -0.644 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.513 HG13 HG23 ' A' 3611 ' ' ILE . 8.1 t -116.98 114.55 46.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.612 -177.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.634 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -97.86 112.72 24.53 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 169.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.523 ' HB2' ' HB ' ' A' 3660 ' ' VAL . 40.5 mt-30 -94.21 110.98 22.68 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.008 -176.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.603 HG12 HG12 ' A' 3659 ' ' ILE . 43.5 mt -91.99 98.33 8.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.341 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -89.23 137.51 29.26 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.767 177.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.31 171.14 9.65 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.755 2.304 . . . . 0.0 111.68 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.42 52.98 2.08 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.671 2.248 . . . . 0.0 112.438 177.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 17.8 p -85.42 162.24 19.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.53 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -48.66 -45.83 39.34 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.597 0.561 . . . . 0.0 111.111 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 16.7 t80 -48.94 -46.29 43.06 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.421 177.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 7.4 m -64.67 -53.97 39.05 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.833 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -64.42 -33.13 75.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.155 -175.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 38.4 m -63.38 -48.6 77.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.106 0.479 . . . . 0.0 110.455 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -68.46 -37.66 80.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.358 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 74.0 mt -62.43 -41.76 98.95 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.667 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 5.1 p -68.35 -30.87 69.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.022 0.439 . . . . 0.0 110.831 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -79.61 -38.62 33.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.122 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.789 HD13 HD22 ' A' 3575 ' ' LEU . 19.4 mt -86.39 -37.31 18.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -144.23 74.85 15.65 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -176.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.92 -21.33 57.32 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.517 2.144 . . . . 0.0 111.828 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . 0.566 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.6 m-20 -73.36 -44.66 58.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.488 -177.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.699 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -84.5 -31.21 24.61 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 177.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.667 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.2 tm? -53.78 -41.31 67.07 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.577 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -64.55 -18.14 64.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.875 -178.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 72.4 m -90.38 -34.32 15.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.824 0.345 . . . . 0.0 111.024 176.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.653 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.8 pt -83.8 -13.36 11.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.688 -174.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 33.7 p -58.34 -28.5 65.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.059 0.457 . . . . 0.0 110.867 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 10.1 m120 -88.75 -33.09 17.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.074 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.653 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.4 tp -105.19 37.54 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 122.218 1.008 . . . . 0.0 109.398 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.491 ' N ' ' HD2' ' A' 3655 ' ' PRO . 7.9 m -35.72 -43.59 0.77 Allowed Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 114.15 -1.386 . . . . 0.0 113.916 173.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' 3654 ' ' SER . 15.0 Cg_endo -59.24 81.59 0.05 OUTLIER 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.925 1.75 . . . . 0.0 112.213 170.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . 0.461 ' CB ' HD23 ' A' 3579 ' ' LEU . 34.3 p80 -155.18 179.7 8.9 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.734 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.458 HD22 HG22 ' A' 3628 ' ' ILE . 23.6 mt -122.75 147.86 46.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.768 -177.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.6 ttp -108.22 110.08 21.62 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 174.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.891 HD12 HD21 ' A' 3524 ' ' LEU . 78.2 mt -103.59 120.49 53.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.149 0.499 . . . . 0.0 111.597 -172.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.854 HG13 ' HD2' ' A' 3573 ' ' TYR . 95.6 t -105.6 115.94 48.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.995 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.634 HG12 ' HG ' ' A' 3626 ' ' LEU . 60.2 mt -90.61 112.4 24.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.6 127.85 56.22 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.985 0.422 . . . . 0.0 111.721 -175.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 22.3 m -81.24 114.39 20.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.108 170.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 52.0 t . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.326 -0.845 . . . . 0.0 109.97 -174.422 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.542 ' CD1' ' HB2' ' A' 3553 ' ' MET . 69.8 m-85 . . . . . 0 N--CA 1.48 1.037 0 CA-C-O 119.754 -0.165 . . . . 0.0 111.418 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.671 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 38.6 mt-10 53.56 -157.44 0.17 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.719 0.771 . . . . 0.0 111.348 177.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.42 ' H ' ' HB3' ' B' 2519 ' ' GLU . 33.3 m -144.81 114.09 7.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 166.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.663 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -176.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.609 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.7 pp . . . . . 0 CA--C 1.531 0.216 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.647 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.15 -15.84 63.01 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.467 -171.52 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.647 ' N ' HD13 ' A' 3502 ' ' LEU . 0.1 OUTLIER -72.17 -19.48 61.74 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.657 ' HD2' ' N ' ' A' 3504 ' ' LYS . 0.0 OUTLIER -104.84 -42.38 5.37 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.073 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.73 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.5 103.04 3.48 Favored Pre-proline 0 N--CA 1.446 -0.631 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.214 178.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . 0.444 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 98.3 Cg_endo -84.99 174.96 6.95 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 124.369 3.38 . . . . 0.0 113.726 -177.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.542 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.1 mt -71.3 136.36 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.432 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.416 HG13 ' HB2' ' A' 3526 ' ' PHE . 29.4 m -104.01 -22.85 4.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.344 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.651 ' HB2' HD13 ' A' 3538 ' ' LEU . 77.1 t-105 -157.73 150.23 22.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.734 -177.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -144.29 118.33 9.44 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.89 -129.53 1.09 Allowed Glycine 0 N--CA 1.441 -0.969 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 -177.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.622 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -141.64 151.46 43.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.186 0.517 . . . . 0.0 111.23 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.501 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.4 mt -105.2 148.79 26.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 169.443 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.673 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.55 124.95 13.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.691 0.281 . . . . 0.0 111.639 -177.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.761 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.56 142.42 41.34 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 173.839 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.761 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 60.38 -91.25 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.904 0.482 . . . . 0.0 109.98 -170.465 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -143.84 9.09 1.51 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -99.14 131.02 45.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.817 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.409 HG22 ' HB2' ' A' 3514 ' ' ALA . 31.1 p -119.54 145.28 46.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.498 -177.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -140.45 116.75 10.64 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.622 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.61 120.85 16.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.107 0.479 . . . . 0.0 110.078 177.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 27.5 m -128.87 148.57 33.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.562 0.696 . . . . 0.0 111.852 -175.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -110.31 125.48 53.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.986 -1.006 . . . . 0.0 108.621 172.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.849 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -96.89 107.82 20.4 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.227 0.537 . . . . 0.0 111.676 -175.378 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.542 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 62.6 m-70 -85.07 138.25 32.54 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.134 175.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.73 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.1 t80 -66.71 137.76 56.91 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 174.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.584 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.0 t -114.94 -58.11 3.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.407 0.622 . . . . 0.0 110.617 176.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.482 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 67.5 m -158.99 172.16 18.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.079 -170.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.13 -156.64 28.59 Favored Glycine 0 N--CA 1.453 -0.186 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.776 177.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.535 ' HB2' ' HA ' ' A' 3571 ' ' THR . 37.9 t30 -100.23 110.92 23.18 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 6.6 p30 -62.89 -26.15 68.64 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.463 -175.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . 0.545 ' O ' ' HG2' ' A' 3536 ' ' ARG . 80.2 t -58.4 -35.42 54.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-O 120.787 0.327 . . . . 0.0 110.418 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.559 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 40.1 mt -58.19 -42.45 86.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.031 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.449 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.09 -41.83 94.63 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.954 0.407 . . . . 0.0 110.432 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 22.8 t60 -58.7 -41.59 86.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.854 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' 3532 ' ' VAL . 14.2 ptp180 -89.5 -9.84 48.49 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.538 ' HB2' HD11 ' A' 3626 ' ' LEU . 33.7 p -99.82 -34.32 10.2 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.126 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.651 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.7 mt -81.33 104.62 3.08 Favored Pre-proline 0 C--N 1.32 -0.698 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' 3537 ' ' SER . 57.3 Cg_endo . . . . . 0 N--CA 1.461 -0.439 0 C-N-CA 123.223 2.615 . . . . 0.0 114.763 -165.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 12.1 Cg_exo . . . . . 0 N--CA 1.462 -0.37 0 CA-C-O 120.831 0.263 . . . . 0.0 111.963 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.689 ' HB3' HD13 ' A' 3612 ' ' ILE . 37.5 mt -81.58 115.73 21.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.912 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' A' 3514 ' ' ALA . 29.1 ptt85 -90.45 140.46 29.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.2 -178.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.473 ' HA ' HG12 ' A' 3612 ' ' ILE . 17.6 mt -92.39 107.86 19.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 CA-C-O 121.944 0.878 . . . . 0.0 110.617 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.55 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.04 -3.17 14.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.064 -172.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.679 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 21.2 mt-30 -151.39 173.19 14.83 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.402 0.144 . . . . 0.0 111.127 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.681 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.42 139.65 17.54 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.847 0.356 . . . . 0.0 111.269 -179.658 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.668 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 16.5 ttt -109.17 142.67 39.64 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.101 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -77.66 110.94 12.93 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.634 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -76.86 97.76 4.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.109 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.637 ' HB2' ' HG2' ' A' 3559 ' ' GLN . 19.4 mm-40 -115.94 165.07 13.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.523 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.589 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.48 -54.6 38.8 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.176 0.297 . . . . 0.0 111.301 -178.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 27.0 p -62.48 -38.29 89.3 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 111.305 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.637 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 29.1 mm-40 -65.97 -46.86 76.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.995 -177.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' 3556 ' ' GLU . 92.0 mt -63.57 -32.01 73.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.084 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.6 mm-40 -65.34 -46.11 81.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.236 0.541 . . . . 0.0 109.952 175.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.17 99.64 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.099 176.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.532 ' O ' ' HG3' ' A' 3567 ' ' MET . 80.8 t -59.63 -45.67 94.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.903 0.382 . . . . 0.0 110.217 175.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.89 -30.04 68.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.737 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -62.35 -37.47 85.78 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -88.01 -7.79 56.56 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.646 176.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' 3563 ' ' VAL . 80.6 mtp -87.21 -24.25 24.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.619 177.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 31.0 p -81.87 -22.43 36.93 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.233 0.539 . . . . 0.0 110.275 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 39.7 t -93.26 80.41 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.644 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -67.21 109.2 2.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.01 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.535 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.0 m 151.77 -40.86 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.587 1.555 . . . . 0.0 108.016 -175.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -86.3 -17.51 34.41 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.689 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.778 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -136.2 163.12 31.11 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.028 0.442 . . . . 0.0 109.976 177.497 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.594 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 43.7 t -126.32 135.63 51.73 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 171.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.77 HD22 HD13 ' A' 3642 ' ' LEU . 14.8 tp -105.4 125.89 51.5 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.576 HD11 HD11 ' A' 3661 ' ' ILE . 73.5 mt -127.16 154.73 44.4 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.758 -177.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.781 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -121.78 108.84 13.97 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.959 178.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.521 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.75 123.16 38.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.384 0.611 . . . . 0.0 110.534 -178.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.46 HD23 ' HB2' ' A' 3656 ' ' HIS . 57.6 mt -125.28 145.57 51.19 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.205 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.22 116.02 2.98 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.415 2.077 . . . . 0.0 111.814 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.8 p -100.73 105.32 16.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.192 0.52 . . . . 0.0 110.842 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.13 145.79 16.15 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.36 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . 0.583 ' HG2' ' HB2' ' A' 3587 ' ' ASP . 9.0 ptp85 -61.44 -32.72 72.7 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.142 0.496 . . . . 0.0 110.993 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.609 ' O ' HG23 ' A' 3588 ' ' VAL . 2.8 p-10 -152.26 -179.45 7.55 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.799 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -49.52 -44.93 46.72 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.591 0.557 . . . . 0.0 111.479 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.93 -49.12 73.85 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 120.823 0.344 . . . . 0.0 110.773 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.583 ' HB2' ' HG2' ' A' 3583 ' ' ARG . 15.8 t0 -62.74 -42.92 99.9 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.968 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' 3584 ' ' ASP . 89.7 t -56.82 -49.35 79.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.674 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 70.9 t -62.19 -44.96 99.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.528 -179.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 32.6 t -61.06 -39.17 88.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.922 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . 0.476 ' HA ' ' OE1' ' A' 3591 ' ' GLN . 12.6 mm-40 -72.83 -35.59 67.31 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.576 178.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 63.9 m -61.01 -53.18 60.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.566 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.538 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 11.1 pt-20 -63.17 -38.67 92.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.171 -178.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.1 m -65.88 -46.52 78.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 0.0 110.56 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.558 HD12 ' HB2' ' A' 3599 ' ' PHE . 62.1 tp -62.44 -45.89 91.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.264 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.847 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 62.7 pttt -70.1 -26.87 64.18 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.48 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.55 -39.47 20.35 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.929 0.395 . . . . 0.0 111.305 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.458 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -89.74 -46.07 8.86 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -172.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.558 ' HB2' HD12 ' A' 3595 ' ' LEU . 18.9 m-85 -99.37 -50.35 4.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.667 0.27 . . . . 0.0 111.619 -175.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.847 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.1 mm -62.15 -55.7 22.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 -176.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 90.4 m -58.04 -43.68 86.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.001 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.728 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -61.11 -56.93 15.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.895 -0.138 . . . . 0.0 110.782 177.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.728 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.7 -43.38 80.46 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -178.671 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -71.58 -38.63 70.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.774 0.321 . . . . 0.0 110.508 -176.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.72 67.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.942 0.401 . . . . 0.0 111.062 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' 3602 ' ' TYR . 73.4 mmtt -83.18 -19.56 36.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.737 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . 0.589 ' O ' ' HG ' ' A' 3555 ' ' LEU . 28.0 mt-30 54.3 47.46 22.95 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -170.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.575 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -127.44 179.0 5.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.791 -171.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.681 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -117.7 118.16 31.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.02 171.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . 0.458 ' N ' HD11 ' A' 3603 ' ' LEU . . . -65.45 102.76 0.71 Allowed Glycine 0 C--O 1.221 -0.672 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.493 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.679 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 30.2 mm -88.88 119.89 36.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.229 0.537 . . . . 0.0 110.695 -175.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.689 HD13 ' HB3' ' A' 3547 ' ' LEU . 36.3 mt -114.86 106.53 20.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.165 176.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.447 ' HA ' ' O ' ' A' 3624 ' ' TYR . 7.7 m120 -84.49 129.06 34.89 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.869 176.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' 3537 ' ' SER . 3.3 p . . . . . 0 C--N 1.317 -0.843 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.656 -178.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.447 ' O ' ' HA ' ' A' 3613 ' ' ASN . 72.2 m-85 . . . . . 0 N--CA 1.45 -0.474 0 CA-C-O 120.95 0.405 . . . . 0.0 110.084 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.475 HG13 HG23 ' A' 3611 ' ' ILE . 11.5 t -120.56 113.46 40.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.003 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.665 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -96.3 110.97 23.19 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 170.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.481 ' HB2' ' HB ' ' A' 3660 ' ' VAL . 44.0 mt-30 -94.1 111.9 23.66 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.205 -177.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.595 HG12 HG12 ' A' 3659 ' ' ILE . 37.1 mt -92.05 97.83 7.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.099 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -89.71 135.92 30.06 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.761 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.564 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 37.3 Cg_endo -66.38 171.02 11.1 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.819 2.346 . . . . 0.0 111.698 177.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.27 42.4 0.38 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.129 2.553 . . . . 0.0 113.126 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 24.1 p -75.37 161.78 28.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.425 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -53.18 -35.73 60.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.516 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 24.2 t80 -53.01 -48.73 67.31 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.888 0.375 . . . . 0.0 111.059 176.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 10.8 m -67.05 -52.52 41.24 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.39 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -57.17 -43.56 82.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.676 -176.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 23.3 m -65.65 -46.35 79.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.035 0.445 . . . . 0.0 110.613 -177.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 8.0 m80 -63.69 -38.5 91.35 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.696 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 69.3 mt -65.76 -40.83 92.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.809 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.65 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 11.6 p -68.59 -27.09 65.74 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.841 -0.343 . . . . 0.0 110.822 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.3 -47.11 13.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 176.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.77 HD13 HD22 ' A' 3575 ' ' LEU . 20.8 mt -77.04 -40.95 44.46 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.394 -173.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.482 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -143.09 86.7 9.06 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-O 120.756 0.313 . . . . 0.0 111.216 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.37 -23.07 28.44 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.662 2.241 . . . . 0.0 113.475 -174.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 20.0 t0 -78.37 -49.41 13.61 Favored 'General case' 0 CA--C 1.516 -0.335 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.241 -174.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.781 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -72.3 -30.48 64.83 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.135 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.65 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -55.78 -45.89 78.06 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.131 177.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.06 -27.69 68.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.035 0.445 . . . . 0.0 111.206 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 6.9 m -79.28 -39.3 33.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.705 178.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.681 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.6 pt -80.79 -11.72 12.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 120.903 0.382 . . . . 0.0 111.522 -174.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 45.5 m -57.94 -26.98 62.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.447 175.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -87.06 -34.74 19.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.368 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.681 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.1 tp -104.35 40.19 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-O 122.292 1.044 . . . . 0.0 109.635 -179.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.44 ' N ' ' HD2' ' A' 3655 ' ' PRO . 49.3 m -33.38 -44.66 0.46 Allowed Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 114.113 -1.403 . . . . 0.0 113.829 169.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.49 ' HG2' HD12 ' A' 3653 ' ' ILE . 13.5 Cg_endo -59.53 76.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 121.707 1.605 . . . . 0.0 111.819 169.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . 0.46 ' HB2' HD23 ' A' 3579 ' ' LEU . 18.5 p80 -146.22 174.06 11.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.781 -176.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.506 HD22 HG22 ' A' 3628 ' ' ILE . 36.5 mt -123.33 144.96 49.11 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.482 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 55.6 ttp -107.17 110.46 22.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.849 HD12 HD21 ' A' 3524 ' ' LEU . 88.9 mt -101.52 115.75 43.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.433 0.635 . . . . 0.0 111.32 -173.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.778 HG13 ' HD2' ' A' 3573 ' ' TYR . 90.8 t -102.75 112.03 34.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.615 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.665 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.7 mt -90.38 112.57 25.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.102 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -112.18 127.46 55.95 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.843 0.354 . . . . 0.0 110.953 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 15.1 p -94.62 109.63 21.53 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 172.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--O 1.249 1.073 0 CA-C-O 117.894 -1.051 . . . . 0.0 111.256 -175.916 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.477 ' CD1' ' HB2' ' A' 3553 ' ' MET . 46.7 m-85 . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.558 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.4 OUTLIER 55.37 -156.65 0.25 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.802 0.81 . . . . 0.0 111.879 174.495 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.434 ' H ' ' HB3' ' B' 2519 ' ' GLU . 4.2 t -153.45 127.01 8.69 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.321 -1.309 . . . . 0.0 107.682 167.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.571 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.39 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.524 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp . . . . . 0 N--CA 1.454 -0.266 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.605 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -71.2 -15.71 62.48 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.177 -174.786 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.605 ' N ' HD13 ' A' 3502 ' ' LEU . 52.3 tptt -71.04 -18.31 62.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.494 0.664 . . . . 0.0 109.46 177.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.44 ' HB3' ' CE2' ' A' 3505 ' ' TYR . 29.2 mmtp -104.91 -44.65 4.77 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.92 174.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.697 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -151.87 105.6 2.85 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.553 -177.671 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . 0.466 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 88.7 Cg_endo -83.69 173.73 9.19 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.952 3.101 . . . . 0.0 113.655 -175.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.59 HG12 ' CD2' ' A' 3525 ' ' HIS . 61.3 mt -71.56 132.03 33.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.524 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.477 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.3 m -100.38 -31.34 3.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.587 -178.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.597 ' HB2' HD13 ' A' 3538 ' ' LEU . 51.4 t-105 -148.59 155.13 40.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 110.521 -177.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -149.02 120.04 7.69 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 176.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -169.58 -127.34 0.92 Allowed Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.649 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.2 mp -141.37 153.91 45.35 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.005 0.431 . . . . 0.0 110.82 178.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.485 HD23 ' HB2' ' A' 3547 ' ' LEU . 98.2 mt -107.78 150.83 26.51 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 169.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.746 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -147.83 124.5 11.13 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.779 0.323 . . . . 0.0 111.608 -178.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.603 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -136.41 139.58 42.55 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 174.256 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.603 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.0 OUTLIER 62.49 -95.26 0.05 OUTLIER 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 -167.634 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 14.0 m120 -140.16 6.6 2.16 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.188 176.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.503 ' O ' ' HA ' ' A' 3514 ' ' ALA . 11.9 m-20 -91.22 127.86 36.82 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.366 -174.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.534 HG22 ' HB2' ' A' 3514 ' ' ALA . 40.4 p -119.89 145.3 46.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.936 0.398 . . . . 0.0 111.627 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -142.87 120.16 11.56 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 174.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.645 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.93 118.6 16.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.964 0.412 . . . . 0.0 109.937 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.433 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 33.5 m -126.55 147.59 31.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.725 0.774 . . . . 0.0 112.525 -174.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -106.24 125.31 50.83 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.614 171.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.89 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -96.16 106.43 18.62 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.42 0.629 . . . . 0.0 111.176 -177.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.59 ' CD2' HG12 ' A' 3507 ' ' ILE . 29.1 m170 -82.96 138.79 33.67 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.407 176.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.697 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.8 t80 -68.93 137.28 53.68 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 174.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.578 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.3 t -114.66 -56.52 4.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.447 0.641 . . . . 0.0 110.871 177.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.419 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 37.6 m -162.87 171.88 15.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.091 -171.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.61 -155.12 26.59 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.348 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . . . . . . . . . 39.2 t30 -100.18 113.82 26.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.619 0.247 . . . . 0.0 110.77 -178.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -64.12 -27.84 69.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.461 -177.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 49.4 t -60.33 -33.09 52.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.865 0.364 . . . . 0.0 110.362 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.476 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 23.0 mt -60.15 -39.76 87.49 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.968 178.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.489 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -67.54 -41.36 84.41 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.542 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 32.3 t60 -64.33 -35.0 79.45 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.895 0.379 . . . . 0.0 110.723 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.45 ' HD3' HD23 ' A' 3533 ' ' LEU . 13.3 ptm180 -89.25 -8.99 52.36 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -177.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.449 ' O ' HG21 ' A' 3614 ' ' VAL . 34.0 p -104.87 -39.89 6.13 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.557 177.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.597 HD13 ' HB2' ' A' 3509 ' ' TRP . 26.0 mt -80.69 109.34 12.75 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.039 0.447 . . . . 0.0 109.911 -174.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . 0.451 ' HD3' HG21 ' A' 3614 ' ' VAL . 61.1 Cg_endo . . . . . 0 N--CA 1.457 -0.647 0 C-N-CA 122.995 2.464 . . . . 0.0 113.057 -172.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . 0.649 ' HA ' ' O ' ' A' 3512 ' ' LEU . 74.0 Cg_endo . . . . . 0 N--CA 1.457 -0.628 0 CA-C-O 121.043 0.351 . . . . 0.0 112.632 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.782 ' HB3' HD13 ' A' 3612 ' ' ILE . 55.3 mt -69.18 120.07 14.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.033 176.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.746 ' HA ' ' O ' ' A' 3514 ' ' ALA . 14.3 ptt180 -93.7 141.14 28.82 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.838 0.351 . . . . 0.0 111.285 -176.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.666 ' CG2' HD23 ' B' 2521 ' ' LEU . 25.2 mt -99.03 106.19 18.52 Favored 'Isoleucine or valine' 0 C--O 1.245 0.84 0 CA-C-O 121.922 0.867 . . . . 0.0 111.075 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.487 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.03 0.06 14.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.607 -174.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.642 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 23.1 mt-30 -148.55 175.31 11.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.514 178.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.806 ' HD3' ' HB2' ' B' 2521 ' ' LEU . 0.0 OUTLIER -159.85 140.11 11.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 111.752 -177.182 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.582 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -110.86 120.46 42.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.226 177.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' 3554 ' ' ARG . 14.8 mmt180 -68.44 109.52 3.73 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.521 ' O ' HD12 ' A' 3555 ' ' LEU . 2.4 pp -71.56 98.3 1.85 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 122.209 1.004 . . . . 0.0 109.623 -177.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.518 ' O ' ' HG ' ' A' 3560 ' ' LEU . 36.3 mt-10 -108.87 164.72 12.14 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.026 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.634 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.16 -50.46 66.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.015 0.436 . . . . 0.0 110.214 179.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 3.0 p -60.5 -40.76 92.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.617 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.527 ' O ' HG23 ' A' 3563 ' ' VAL . 15.2 mm-40 -63.36 -50.1 71.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.697 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' 3556 ' ' GLU . 85.0 mt -61.13 -31.88 71.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.297 -176.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.634 ' HG2' ' O ' ' A' 3557 ' ' ALA . 18.3 mm-40 -60.74 -50.85 71.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.226 0.536 . . . . 0.0 109.754 174.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . 0.409 ' HA2' ' HD2' ' A' 3565 ' ' ARG . . . -63.87 -39.64 97.56 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.168 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.556 ' O ' ' HG3' ' A' 3567 ' ' MET . 90.4 t -60.24 -48.54 87.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.59 0.234 . . . . 0.0 110.782 177.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.66 -30.35 68.68 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.574 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.518 ' HG3' ' O ' ' A' 3561 ' ' GLU . 99.7 mtt180 -57.64 -42.36 83.27 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.528 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' 3563 ' ' VAL . 11.5 ptp180 -87.06 -13.59 43.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.949 0.404 . . . . 0.0 110.604 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.556 ' HG3' ' O ' ' A' 3563 ' ' VAL . 85.6 mtp -79.53 -26.54 41.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.988 0.423 . . . . 0.0 110.593 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 15.1 t -85.0 1.37 47.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.188 0.518 . . . . 0.0 110.065 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 40.9 t -116.7 84.32 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.489 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.785 176.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -72.8 108.49 5.79 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . . . . . . . . . 1.5 m 155.38 -43.52 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 O-C-N 124.998 1.436 . . . . 0.0 108.059 -173.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -86.65 -27.29 23.88 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.968 -177.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.771 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -129.41 162.08 28.87 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.939 178.215 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.625 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 48.8 t -124.41 136.91 54.43 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 170.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.791 HD22 HD13 ' A' 3642 ' ' LEU . 14.6 tp -105.85 125.44 50.99 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.634 HD11 HD11 ' A' 3661 ' ' ILE . 82.3 mt -127.11 153.21 46.3 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.111 0.481 . . . . 0.0 110.725 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.644 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.44 107.15 12.54 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.15 -179.538 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.465 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 124.01 38.16 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.416 0.627 . . . . 0.0 110.473 -177.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.476 HD23 ' HB2' ' A' 3656 ' ' HIS . 84.8 mt -125.42 146.31 53.97 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.155 -178.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.32 117.04 3.72 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.195 1.93 . . . . 0.0 111.88 176.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.2 p -107.21 106.7 17.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.286 0.565 . . . . 0.0 110.579 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . 0.405 ' H ' HG22 ' A' 3588 ' ' VAL . . . -103.61 147.13 16.62 Favored Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.265 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . 0.423 ' HG2' ' CB ' ' A' 3587 ' ' ASP . 35.5 ptt180 -59.01 -35.03 72.56 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.254 0.55 . . . . 0.0 111.115 177.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.573 ' O ' HG23 ' A' 3588 ' ' VAL . 10.3 t70 -142.84 174.19 10.88 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -55.93 -33.86 65.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 118.613 0.642 . . . . 0.0 109.916 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . 0.407 ' HG3' ' H ' ' A' 3586 ' ' GLU . 20.1 mt-10 -56.49 -54.68 42.93 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.379 175.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.502 ' O ' ' HG2' ' A' 3591 ' ' GLN . 3.1 t70 -65.84 -36.04 82.35 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.718 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' 3584 ' ' ASP . 99.2 t -57.49 -48.03 83.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.299 178.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 65.9 t -60.19 -44.06 94.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.02 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 43.7 t -60.7 -46.59 89.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.153 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' 3587 ' ' ASP . 70.9 mm-40 -65.15 -41.48 94.69 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 178.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 59.5 m -59.63 -53.28 59.83 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.959 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.39 -36.97 85.89 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.08 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 46.1 m -67.37 -44.52 78.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.883 0.373 . . . . 0.0 110.398 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.554 HD12 ' HB2' ' A' 3599 ' ' PHE . 46.5 tp -65.11 -46.4 81.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.983 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.772 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.93 -31.06 71.77 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.084 -176.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.09 -42.26 17.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.674 0.274 . . . . 0.0 111.363 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.4 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -88.16 -45.67 9.92 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -170.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.554 ' HB2' HD12 ' A' 3595 ' ' LEU . 14.3 m-85 -99.48 -50.27 4.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.766 0.317 . . . . 0.0 111.245 -176.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.772 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 26.0 mm -61.56 -60.04 3.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.217 -175.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 88.8 m -59.08 -32.09 69.47 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 123.185 0.303 . . . . 0.0 111.238 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 42.1 t80 -77.09 -57.04 4.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.569 -177.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' 3608 ' ' ALA . 0.4 OUTLIER -55.97 -38.62 70.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.235 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.39 -32.82 64.68 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.859 -0.337 . . . . 0.0 110.168 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.48 93.54 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.209 0.528 . . . . 0.0 110.689 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -81.38 -16.82 51.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.057 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . 0.418 ' O ' ' HG ' ' A' 3555 ' ' LEU . 55.1 mt-30 53.22 49.58 19.59 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -169.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.554 ' O ' HD12 ' A' 3603 ' ' LEU . . . -131.12 -178.78 4.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.334 0.588 . . . . 0.0 112.373 -171.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.752 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.81 118.35 30.59 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.572 176.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . 0.419 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.61 104.84 0.92 Allowed Glycine 0 C--O 1.222 -0.594 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.562 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.642 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 36.4 mm -89.6 121.67 40.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.207 0.527 . . . . 0.0 111.066 -175.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.782 HD13 ' HB3' ' A' 3547 ' ' LEU . 19.3 mt -117.07 113.01 41.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.024 177.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.443 ' HA ' ' O ' ' A' 3624 ' ' TYR . 38.1 m-80 -92.09 108.01 19.63 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.445 -179.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.451 HG21 ' HD3' ' A' 3539 ' ' PRO . 7.2 p . . . . . 0 C--N 1.316 -0.864 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.635 -171.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.443 ' O ' ' HA ' ' A' 3613 ' ' ASN . 82.7 m-85 . . . . . 0 CA--C 1.513 -0.458 0 CA-C-O 120.891 0.377 . . . . 0.0 110.726 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.423 HG13 HD12 ' A' 3611 ' ' ILE . 4.4 t -118.76 113.92 43.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.287 178.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.624 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.9 mp -97.83 115.53 28.24 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 169.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.56 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 44.0 mt-30 -94.72 111.44 23.22 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.702 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.599 HG12 HG12 ' A' 3659 ' ' ILE . 38.7 mt -90.16 98.59 8.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.254 178.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -86.83 139.72 33.05 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.096 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -67.94 172.81 10.19 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.695 2.263 . . . . 0.0 111.52 176.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.21 43.59 0.5 Allowed 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 122.892 2.395 . . . . 0.0 112.58 176.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 24.5 p -74.82 162.84 28.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.767 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -52.25 -40.75 62.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.202 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 31.3 t80 -50.43 -44.65 55.42 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.122 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.5 m -67.54 -56.92 7.58 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.655 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -57.11 -41.42 78.93 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.323 -0.399 . . . . 0.0 112.056 -175.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 12.0 p -66.83 -47.23 72.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.913 0.387 . . . . 0.0 110.869 -177.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 22.4 m-70 -66.9 -36.99 83.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.508 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 77.5 mt -61.89 -35.85 79.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.72 0.295 . . . . 0.0 110.819 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.876 ' HA ' HD22 ' A' 3647 ' ' LEU . 38.2 t -63.4 -37.77 88.58 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.182 0.515 . . . . 0.0 110.491 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . 0.594 ' NE ' ' HA ' ' A' 3641 ' ' ARG . 1.7 mmp_? -80.44 -32.23 37.34 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.011 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.791 HD13 HD22 ' A' 3575 ' ' LEU . 32.8 mt -96.63 -27.15 14.94 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -171.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.432 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -159.32 79.69 2.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -178.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . 0.514 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 3.0 Cg_exo -73.75 -18.75 21.83 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.635 2.224 . . . . 0.0 111.546 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . 0.483 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 6.9 m-20 -69.52 -49.91 50.05 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.123 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.644 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -82.71 -25.01 33.35 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.278 179.147 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.876 HD22 ' HA ' ' A' 3640 ' ' SER . 34.8 tp -52.6 -49.69 64.53 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.581 178.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.52 -18.47 59.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.009 0.433 . . . . 0.0 111.632 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 15.5 m -87.33 -38.26 16.39 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.59 178.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.61 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.0 pt -78.72 -21.76 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -175.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 47.2 m -52.39 -30.31 28.4 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 120.765 0.317 . . . . 0.0 111.326 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -82.96 -42.86 17.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.951 0.405 . . . . 0.0 109.954 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.61 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.6 tp -96.88 39.07 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-O 122.76 1.267 . . . . 0.0 109.168 -178.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.492 ' N ' ' HD2' ' A' 3655 ' ' PRO . 4.3 p -40.41 -37.26 0.84 Allowed Pre-proline 0 CA--C 1.545 0.766 0 CA-C-N 113.449 -1.705 . . . . 0.0 114.961 174.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' 3654 ' ' SER . 22.9 Cg_endo -63.89 74.07 0.17 Allowed 'Trans proline' 0 C--N 1.358 1.038 0 CA-C-N 121.053 1.412 . . . . 0.0 111.529 170.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . 0.476 ' HB2' HD23 ' A' 3579 ' ' LEU . 18.1 p80 -139.36 173.78 11.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.323 -175.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.473 HD22 HG22 ' A' 3628 ' ' ILE . 32.3 mt -121.69 148.46 44.57 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.33 178.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.3 ttp -111.21 107.89 17.36 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 174.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.89 HD12 HD21 ' A' 3524 ' ' LEU . 74.9 mt -100.91 117.26 45.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.285 0.564 . . . . 0.0 111.524 -171.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.771 HG13 ' HD2' ' A' 3573 ' ' TYR . 56.5 t -101.76 115.93 44.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.147 -178.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.634 HD11 HD11 ' A' 3576 ' ' LEU . 68.0 mt -90.34 113.12 25.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 177.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -108.94 127.34 53.98 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.914 0.388 . . . . 0.0 110.851 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 32.0 t -93.47 136.4 33.78 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.69 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 5.1 m . . . . . 0 C--O 1.246 0.907 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.453 179.739 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.582 ' CD1' ' HB2' ' A' 3553 ' ' MET . 11.8 m-85 . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.634 ' HG2' ' H ' ' B' 2520 ' ' THR . 35.6 tt0 57.85 -163.34 0.2 Allowed 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 174.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.634 ' H ' ' HG2' ' B' 2519 ' ' GLU . 41.3 m -150.56 124.23 9.13 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.806 ' HB2' ' HD3' ' A' 3552 ' ' ARG . 7.1 tp . . . . . 0 C--N 1.33 -0.276 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.463 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.54 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.0 pp . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.652 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.48 -16.96 64.5 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.677 0.671 . . . . 0.0 110.278 -175.327 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.652 ' N ' HD13 ' A' 3502 ' ' LEU . 56.0 tptt -66.42 -25.8 66.92 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 121.358 0.599 . . . . 0.0 109.385 177.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' 3504 ' ' LYS . 61.1 mmtt -105.58 -42.23 5.26 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.992 177.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.637 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.19 105.64 3.16 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 121.503 0.668 . . . . 0.0 111.521 -177.657 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -82.86 175.34 8.74 Favored 'Trans proline' 0 CA--C 1.533 0.43 0 C-N-CA 124.24 3.293 . . . . 0.0 113.248 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.487 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 90.9 mt -70.78 132.85 32.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.136 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.565 HG13 ' HB2' ' A' 3526 ' ' PHE . 29.2 m -100.76 -26.39 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.189 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.64 ' HB2' HD13 ' A' 3538 ' ' LEU . 43.2 t-105 -154.89 156.37 36.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.882 0.372 . . . . 0.0 110.779 -178.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . 0.436 HE21 ' HB3' ' A' 3510 ' ' GLN . 0.9 OUTLIER -151.29 119.22 6.21 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.74 -131.05 1.29 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.485 -0.646 . . . . 0.0 111.485 -176.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.637 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -140.55 150.38 43.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.217 0.532 . . . . 0.0 111.569 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.46 HD23 ' HB2' ' A' 3547 ' ' LEU . 83.1 mt -105.55 154.02 20.96 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 170.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.718 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -148.72 126.53 11.86 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.491 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.689 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.68 140.62 38.88 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 172.549 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.689 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.4 OUTLIER 62.52 -93.0 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -169.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 8.8 m120 -143.36 11.34 1.71 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 171.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.537 ' HB3' ' HB1' ' A' 3598 ' ' ALA . 27.9 m-20 -88.03 116.98 26.59 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.152 -176.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 21.8 p -110.54 133.42 53.31 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.91 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . 1.009 ' HB1' HE22 ' A' 3591 ' ' GLN . . . -135.11 120.1 18.63 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.379 177.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.637 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.93 117.76 16.09 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.209 0.528 . . . . 0.0 110.493 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.423 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 28.9 m -127.95 147.48 32.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.725 0.774 . . . . 0.0 112.126 -175.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -105.71 125.81 51.42 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.937 173.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.843 HD21 HD12 ' A' 3659 ' ' ILE . 2.0 mt -97.06 105.96 18.21 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.498 0.666 . . . . 0.0 111.573 -176.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.487 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 26.0 m-70 -86.26 138.9 31.5 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.922 -1.035 . . . . 0.0 108.695 176.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.637 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.7 t80 -68.57 139.32 55.56 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.556 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.8 t -114.83 -55.67 4.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-O 121.298 0.57 . . . . 0.0 110.994 177.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 58.5 m -163.75 170.76 16.5 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.276 -172.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.87 -150.96 22.66 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.483 174.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.532 ' HB2' ' HA ' ' A' 3571 ' ' THR . 53.8 t-20 -93.45 107.74 19.53 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.342 -0.429 . . . . 0.0 110.553 -175.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -64.06 -30.82 71.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.634 0.254 . . . . 0.0 110.947 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 45.0 t -64.22 -31.57 53.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.955 0.407 . . . . 0.0 110.007 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.513 HD12 ' HB3' ' A' 3530 ' ' ASN . 16.6 mt -59.39 -40.2 85.81 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.774 176.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.408 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.87 -39.35 87.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.909 0.385 . . . . 0.0 110.267 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -61.35 -40.18 93.33 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -89.43 -10.13 47.62 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -176.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.652 ' O ' HG11 ' A' 3614 ' ' VAL . 77.5 p -103.87 -37.15 7.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.932 0.396 . . . . 0.0 111.416 -179.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.64 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.1 mt -81.85 111.35 25.82 Favored Pre-proline 0 C--N 1.318 -0.783 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo . . . . . 0 N--CA 1.458 -0.584 0 C-N-CA 122.439 2.093 . . . . 0.0 112.985 -174.187 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . 0.401 ' HA ' ' O ' ' A' 3512 ' ' LEU . 22.0 Cg_endo . . . . . 0 N--CA 1.462 -0.366 0 CA-C-O 121.051 0.355 . . . . 0.0 112.428 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.708 ' HB3' HD13 ' A' 3612 ' ' ILE . 65.4 mt -69.29 109.51 4.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.175 178.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.718 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.1 OUTLIER -90.51 134.82 34.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.879 0.371 . . . . 0.0 110.513 -177.784 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.515 HG12 HD11 ' A' 3612 ' ' ILE . 16.9 mt -90.52 107.29 18.3 Favored 'Isoleucine or valine' 0 C--O 1.248 0.997 0 CA-C-O 122.401 1.096 . . . . 0.0 111.061 -177.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.617 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -119.81 10.61 11.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.425 -174.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.788 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 32.1 mt-30 -154.49 167.68 29.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.832 -0.167 . . . . 0.0 110.558 179.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.41 143.27 14.85 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.869 0.366 . . . . 0.0 111.785 -177.221 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.539 ' O ' ' HA ' ' A' 3608 ' ' ALA . 12.4 tmm? -119.09 134.72 55.03 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.304 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -70.81 109.67 5.13 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.615 ' O ' HD12 ' A' 3555 ' ' LEU . 2.6 pp -74.57 98.23 3.33 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.115 0.96 . . . . 0.0 109.801 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' 3559 ' ' GLN . 19.1 mm-40 -116.36 172.15 7.38 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.296 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.62 68.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.693 0.282 . . . . 0.0 111.268 -176.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 60.1 p -71.11 -37.22 72.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.162 -178.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.492 ' O ' HG23 ' A' 3563 ' ' VAL . 11.7 mm-40 -63.69 -49.51 72.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.536 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.09 -35.79 79.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.029 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -66.65 -44.16 82.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.053 0.454 . . . . 0.0 110.586 174.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -52.53 -42.12 57.27 Favored Glycine 0 CA--C 1.518 0.254 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.993 173.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.521 ' O ' ' HG3' ' A' 3567 ' ' MET . 42.7 t -65.82 -49.6 76.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 174.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . 0.574 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.08 -27.2 63.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.817 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.545 ' O ' HG22 ' A' 3568 ' ' THR . 0.0 OUTLIER -58.57 -45.57 88.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.88 177.443 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -87.79 -4.44 58.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.074 0.464 . . . . 0.0 110.711 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.574 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 87.6 mtp -85.94 -15.88 40.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.141 178.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . 0.545 HG22 ' O ' ' A' 3565 ' ' ARG . 11.6 t -85.95 3.13 43.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.11 0.481 . . . . 0.0 110.32 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 20.6 t -117.48 89.61 1.39 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.473 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.14 110.31 3.93 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.532 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.5 m 142.24 -42.97 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.774 1.629 . . . . 0.0 108.279 -177.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.24 -31.16 43.5 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.092 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.691 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -129.85 167.44 18.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.36 -0.382 . . . . 0.0 109.988 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.654 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 49.8 t -128.16 137.15 51.95 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.813 HD22 HD13 ' A' 3642 ' ' LEU . 14.1 tp -106.98 125.97 51.7 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 178.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.592 HD11 HD11 ' A' 3661 ' ' ILE . 75.6 mt -127.41 152.42 47.54 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.04 0.448 . . . . 0.0 110.911 -177.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.652 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.35 107.55 13.07 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.52 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.66 119.2 32.93 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.376 0.608 . . . . 0.0 110.339 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.437 ' HG ' HD12 ' A' 3577 ' ' LEU . 48.2 mt -117.19 147.92 41.37 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.251 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . 0.457 ' HG2' HD11 ' A' 3653 ' ' ILE . 19.3 Cg_endo -60.45 123.06 12.3 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.234 1.956 . . . . 0.0 111.932 175.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.8 p -117.0 116.53 27.55 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.465 0.65 . . . . 0.0 110.887 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . 0.518 ' H ' HG22 ' A' 3588 ' ' VAL . . . -103.66 146.77 16.5 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.948 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -62.78 -36.22 82.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.594 0.711 . . . . 0.0 109.226 178.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.6 ' O ' HG23 ' A' 3588 ' ' VAL . 16.9 t70 -131.23 166.17 21.75 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -55.85 -39.12 70.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.833 0.349 . . . . 0.0 110.648 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -66.42 -42.5 87.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.998 0.427 . . . . 0.0 110.37 177.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.484 ' HB3' ' H ' ' A' 3584 ' ' ASP . 24.1 t70 -61.42 -38.52 87.44 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.152 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' 3584 ' ' ASP . 78.9 t -56.33 -47.41 81.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.44 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 83.0 t -59.42 -47.43 90.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.324 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 36.1 t -60.65 -45.5 93.86 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.162 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . 1.009 HE22 ' HB1' ' A' 3520 ' ' ALA . 25.9 tp60 -67.56 -41.58 83.98 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.826 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . 0.514 ' O ' ' HG3' ' A' 3596 ' ' LYS . 87.7 m -57.6 -52.37 65.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.516 0.198 . . . . 0.0 110.991 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.549 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 12.2 pt-20 -65.13 -31.13 72.16 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.759 0.314 . . . . 0.0 111.32 -178.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 48.9 m -68.71 -48.62 63.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.848 0.356 . . . . 0.0 110.38 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.621 HD12 ' HB2' ' A' 3599 ' ' PHE . 55.9 tp -62.19 -41.89 98.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.843 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.549 ' HE2' ' HA ' ' A' 3593 ' ' GLU . 53.4 mtmt -57.77 -48.16 80.46 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.008 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -75.85 -39.57 56.33 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.537 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -86.97 -46.77 9.54 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -169.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.621 ' HB2' HD12 ' A' 3595 ' ' LEU . 17.4 m-85 -99.51 -50.45 4.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.818 0.342 . . . . 0.0 111.283 -177.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.538 ' HB ' ' O ' ' A' 3596 ' ' LYS . 31.1 mm -61.07 -55.84 21.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.69 -175.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 48.0 m -60.48 -45.94 91.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.248 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.725 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -60.14 -52.28 66.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.724 0.297 . . . . 0.0 110.648 179.193 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.725 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -67.78 -34.1 76.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.785 0.326 . . . . 0.0 110.833 -170.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -76.62 -38.89 53.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.139 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.94 -41.12 78.49 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 120.804 0.335 . . . . 0.0 110.936 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -78.32 -10.45 59.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.395 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . 0.411 ' O ' ' HG ' ' A' 3555 ' ' LEU . 43.0 mt-30 55.17 47.93 20.64 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.334 0.396 . . . . 0.0 111.017 178.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -133.88 171.43 14.19 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -171.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -104.4 117.82 35.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.213 170.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -67.78 104.37 1.15 Allowed Glycine 0 C--O 1.222 -0.598 0 C-N-CA 120.636 -0.793 . . . . 0.0 111.702 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.788 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 31.9 mm -90.38 131.24 38.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.073 0.463 . . . . 0.0 111.14 -174.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.708 HD13 ' HB3' ' A' 3547 ' ' LEU . 55.3 mt -131.46 108.83 15.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.039 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.688 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.0 m120 -81.06 136.47 35.96 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.25 0.547 . . . . 0.0 111.033 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.652 HG11 ' O ' ' A' 3537 ' ' SER . 21.3 t . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.807 -177.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.688 ' O ' ' HA ' ' A' 3613 ' ' ASN . 62.0 m-85 . . . . . 0 CA--C 1.509 -0.621 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.459 HG13 HG23 ' A' 3611 ' ' ILE . 3.8 t -125.2 113.71 36.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.003 177.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.636 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -96.74 112.19 24.05 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 169.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -94.51 110.57 22.36 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -178.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.594 HG12 HG12 ' A' 3659 ' ' ILE . 32.9 mt -90.98 99.26 9.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.993 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . 0.444 ' CE1' ' HB2' ' A' 3609 ' ' ALA . 78.3 m-85 -89.83 138.44 27.88 Favored Pre-proline 0 C--N 1.318 -0.778 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.12 178.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.597 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 36.4 Cg_endo -65.53 169.57 12.49 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.556 2.171 . . . . 0.0 111.113 175.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.0 53.45 1.53 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 122.703 2.269 . . . . 0.0 112.51 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 26.0 p -81.03 162.63 23.71 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.429 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -52.2 -41.06 62.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.542 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 26.4 t80 -57.46 -44.73 85.03 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 14.6 m -61.58 -58.47 7.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.77 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -60.16 -37.87 81.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.465 -174.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 39.6 m -66.81 -49.97 64.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.838 0.352 . . . . 0.0 110.74 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -65.38 -32.63 74.37 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.554 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 50.8 mt -63.5 -35.19 79.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.365 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.661 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 19.3 t -72.04 -33.33 67.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.049 0.452 . . . . 0.0 110.148 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -78.97 -30.65 44.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.02 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.813 HD13 HD22 ' A' 3575 ' ' LEU . 22.4 mt -93.49 -38.84 11.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.893 -177.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -144.64 74.93 14.94 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -176.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . 0.44 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 36.5 Cg_endo -66.58 -17.8 53.38 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 122.485 2.123 . . . . 0.0 112.324 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . 0.598 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.3 m-20 -72.66 -50.01 27.89 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.338 -177.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.652 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -82.56 -27.04 31.85 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 178.38 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.661 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -53.49 -42.99 67.85 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.156 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -65.18 -17.97 64.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.635 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 15.0 m -89.75 -34.19 16.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.923 0.392 . . . . 0.0 110.72 177.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.717 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.4 pt -85.52 -13.37 11.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -174.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 12.0 p -56.72 -31.31 64.4 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.192 0.52 . . . . 0.0 110.464 175.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 9.4 t30 -83.31 -36.74 24.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.673 174.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.717 HG22 ' HA ' ' A' 3650 ' ' ILE . 20.8 tt -104.59 45.17 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 122.741 1.258 . . . . 0.0 110.103 -177.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.471 ' N ' ' HD2' ' A' 3655 ' ' PRO . 19.9 m -33.7 -42.0 0.36 Allowed Pre-proline 0 CA--C 1.541 0.624 0 CA-C-N 113.403 -1.726 . . . . 0.0 113.845 166.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.517 ' HD2' ' C ' ' A' 3653 ' ' ILE . 23.6 Cg_endo -65.02 84.16 0.18 Allowed 'Trans proline' 0 C--N 1.359 1.123 0 CA-C-N 120.532 1.226 . . . . 0.0 111.715 173.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 28.6 p80 -152.15 173.35 15.06 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.137 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.423 HD22 HG22 ' A' 3628 ' ' ILE . 35.4 mt -121.98 142.27 50.49 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.165 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.6 ttp -105.16 111.23 23.9 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 176.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.843 HD12 HD21 ' A' 3524 ' ' LEU . 85.5 mt -103.61 119.59 52.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.264 0.554 . . . . 0.0 111.381 -172.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.691 HG13 ' HD2' ' A' 3573 ' ' TYR . 87.1 t -106.35 113.31 42.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.859 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.654 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 46.8 mt -91.02 113.7 27.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.082 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.58 129.22 56.14 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.71 0.291 . . . . 0.0 111.503 -178.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 4.7 m -71.65 116.54 12.14 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 172.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 45.7 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.527 -0.749 . . . . 0.0 110.567 -177.578 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.525 ' CD1' ' HB2' ' A' 3553 ' ' MET . 22.9 m-85 . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 120.48 0.181 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.912 ' HG3' ' H ' ' B' 2520 ' ' THR . 2.4 tp10 57.69 -159.19 0.26 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.884 0.373 . . . . 0.0 110.281 175.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.912 ' H ' ' HG3' ' B' 2519 ' ' GLU . 89.5 m -150.75 133.7 15.95 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 171.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.617 ' H ' ' C ' ' A' 3550 ' ' ALA . 35.7 tp . . . . . 0 CA--C 1.516 -0.354 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.301 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.576 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp . . . . . 0 N--CA 1.457 -0.092 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.633 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -68.12 -16.38 63.98 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.417 -172.307 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.633 ' N ' HD13 ' A' 3502 ' ' LEU . 0.7 OUTLIER -78.2 -21.03 50.67 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.18 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -98.7 -43.0 6.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.356 0.598 . . . . 0.0 109.74 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.709 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -147.51 100.15 3.81 Favored Pre-proline 0 N--CA 1.444 -0.739 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.773 179.934 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -82.71 173.89 10.03 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 123.985 3.123 . . . . 0.0 113.693 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.575 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 90.3 mt -71.23 133.73 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.047 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.463 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.0 m -101.95 -30.0 3.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.481 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.778 ' HE3' HD12 ' A' 3524 ' ' LEU . 26.1 t90 -147.04 154.64 41.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.652 0.263 . . . . 0.0 110.373 -174.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -150.59 121.55 7.66 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -175.78 -129.33 1.2 Allowed Glycine 0 N--CA 1.441 -0.976 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -178.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.644 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -140.13 152.18 45.9 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.076 0.465 . . . . 0.0 111.07 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.473 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.0 mt -105.69 149.72 26.12 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 168.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.55 125.97 14.02 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -177.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.644 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.86 144.89 41.63 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 172.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.644 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.3 OUTLIER 62.63 -90.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.051 0.54 . . . . 0.0 110.337 -169.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -148.65 12.97 0.91 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.45 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.41 ' O ' ' HA ' ' A' 3514 ' ' ALA . 20.8 m-20 -106.01 144.06 33.26 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.76 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.514 HG22 ' HB2' ' A' 3514 ' ' ALA . 20.0 p -125.94 143.6 51.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.473 -177.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.67 115.06 13.36 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.256 174.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.644 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.44 116.34 12.77 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.956 0.407 . . . . 0.0 109.913 179.007 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.422 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -128.57 148.0 33.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 121.607 0.718 . . . . 0.0 111.75 -175.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -109.26 125.36 52.19 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.854 173.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.842 HD21 HD12 ' A' 3659 ' ' ILE . 1.0 OUTLIER -94.51 112.42 24.19 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.39 0.614 . . . . 0.0 111.86 -174.784 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.575 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 62.9 m-70 -88.15 138.53 31.36 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.799 176.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.709 ' O ' ' HB2' ' A' 3505 ' ' TYR . 66.2 t80 -67.28 138.18 56.66 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 174.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.559 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.3 t -114.99 -58.38 3.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.177 0.513 . . . . 0.0 110.971 177.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.508 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 58.3 m -160.2 171.4 19.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.537 -171.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.61 -148.96 20.26 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.125 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.552 ' HB2' ' HA ' ' A' 3571 ' ' THR . 44.0 t-20 -108.23 118.53 37.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.945 0.402 . . . . 0.0 110.117 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.8 p30 -63.34 -28.21 69.85 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.907 -174.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 57.5 t -60.88 -33.47 55.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.752 0.311 . . . . 0.0 110.722 -177.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.536 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 19.7 mt -57.65 -42.68 83.97 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.076 177.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.401 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -68.38 -38.44 81.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.881 0.372 . . . . 0.0 110.907 -178.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 29.8 t60 -66.17 -36.48 83.22 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.612 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -89.73 -6.29 56.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . . . . . . . . . 20.5 p -104.04 -43.34 5.3 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 122.005 -0.434 . . . . 0.0 111.271 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.662 HD13 ' HB2' ' A' 3509 ' ' TRP . 22.4 mt -79.36 110.81 16.5 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.982 0.42 . . . . 0.0 110.196 -173.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . 0.508 ' HD3' HG21 ' A' 3614 ' ' VAL . 36.6 Cg_endo . . . . . 0 N--CA 1.462 -0.336 0 C-N-CA 122.965 2.443 . . . . 0.0 112.87 -174.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . 0.622 ' HA ' ' O ' ' A' 3512 ' ' LEU . 29.0 Cg_endo . . . . . 0 C--O 1.236 0.403 0 N-CA-C 113.211 0.427 . . . . 0.0 113.211 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.733 ' HB3' HD13 ' A' 3612 ' ' ILE . 39.1 mt -69.27 118.64 12.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.834 174.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -99.22 139.23 35.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 111.643 -174.342 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.407 ' CG2' HD13 ' B' 2521 ' ' LEU . 25.9 mt -95.6 107.83 20.16 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 121.603 0.716 . . . . 0.0 111.609 -175.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.496 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -118.08 1.98 12.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.002 -175.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.667 ' HA ' ' HA ' ' B' 2520 ' ' THR . 62.4 mt-30 -145.64 171.43 14.73 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.527 -0.175 . . . . 0.0 110.527 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.792 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.2 138.89 11.66 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 120.73 0.3 . . . . 0.0 111.172 -179.691 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.572 ' HG3' ' CE1' ' B' 2518 ' ' TYR . 10.8 tmm? -109.67 132.27 54.3 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.116 -0.233 . . . . 0.0 110.885 -178.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' 3554 ' ' ARG . 0.1 OUTLIER -63.71 109.03 1.57 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.181 -179.426 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.554 ' HB2' HD21 ' A' 3560 ' ' LEU . 3.5 pp -81.95 97.27 8.0 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 122.754 1.264 . . . . 0.0 109.411 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.56 ' H ' ' HB2' ' A' 3559 ' ' GLN . 13.9 mm-40 -111.4 166.49 11.08 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.741 -1.572 . . . . 0.0 108.855 177.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.503 ' O ' ' HG3' ' A' 3561 ' ' GLU . . . -54.02 -52.39 60.97 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.973 0.416 . . . . 0.0 111.038 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 25.5 p -65.6 -40.1 92.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.138 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.56 ' HB2' ' H ' ' A' 3556 ' ' GLU . 15.9 mm100 -65.03 -40.45 94.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.276 -179.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' 3555 ' ' LEU . 98.5 mt -62.85 -37.94 88.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.772 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' 3557 ' ' ALA . 12.8 mt-10 -68.65 -33.22 73.63 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 175.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . 0.481 ' O ' ' HB3' ' A' 3565 ' ' ARG . . . -64.75 -33.52 87.44 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.647 173.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.564 ' O ' ' HG2' ' A' 3566 ' ' ARG . 56.4 t -70.69 -45.75 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 174.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . 0.549 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.54 -27.03 64.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.122 178.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.481 ' HB3' ' O ' ' A' 3562 ' ' GLY . 75.5 ttt180 -55.3 -45.02 76.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.178 177.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' 3563 ' ' VAL . 9.2 ptp180 -87.2 -14.7 40.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.961 0.41 . . . . 0.0 110.844 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.549 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 78.0 mtp -83.3 -20.1 35.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.537 -176.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 11.2 t -88.1 4.04 46.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.959 0.409 . . . . 0.0 110.842 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 46.4 t -127.39 102.65 9.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-O 121.05 0.452 . . . . 0.0 110.748 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . 0.571 ' O ' ' HB ' ' A' 3571 ' ' THR . 1.7 mp0 -62.01 139.8 58.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.074 177.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.571 ' HB ' ' O ' ' A' 3570 ' ' GLU . 73.4 m 95.1 -27.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 O-C-N 124.199 0.937 . . . . 0.0 110.069 179.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.01 -31.57 50.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.72 171.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.731 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -138.28 167.17 22.42 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.048 177.708 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.643 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 29.4 t -129.11 135.99 49.62 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 171.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.759 HD22 HD13 ' A' 3642 ' ' LEU . 13.9 tp -106.58 126.31 52.11 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.614 HD11 HD11 ' A' 3661 ' ' ILE . 82.4 mt -128.17 151.79 48.82 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.596 -178.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.628 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -118.76 109.11 15.68 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.915 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.549 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.08 119.05 32.39 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.406 0.622 . . . . 0.0 110.469 -177.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.451 ' HG ' HD12 ' A' 3577 ' ' LEU . 82.9 mt -121.57 142.31 35.42 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.73 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.48 134.94 61.47 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.234 1.956 . . . . 0.0 111.359 177.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.2 p -124.52 114.53 19.55 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.142 0.496 . . . . 0.0 110.461 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . 0.404 ' HA2' ' OD2' ' A' 3587 ' ' ASP . . . -104.23 146.33 16.25 Favored Glycine 0 N--CA 1.443 -0.851 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.588 -178.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 13.1 mtm-85 -62.55 -48.87 77.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.757 0.789 . . . . 0.0 109.359 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.589 ' O ' HG23 ' A' 3588 ' ' VAL . 5.0 m-20 -125.87 174.95 8.01 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.177 -176.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -53.48 -48.4 68.95 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.347 0.404 . . . . 0.0 110.886 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -64.76 -38.96 92.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.58 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.446 ' HB3' ' H ' ' A' 3584 ' ' ASP . 27.8 t70 -65.15 -41.91 94.28 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.218 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' 3584 ' ' ASP . 79.2 t -57.25 -43.61 82.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.501 176.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 11.7 t -62.49 -50.91 77.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.481 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 6.0 m -55.83 -48.58 75.2 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.363 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -64.28 -41.71 96.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.577 0.227 . . . . 0.0 110.848 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . 0.445 ' O ' ' HG3' ' A' 3596 ' ' LYS . 28.8 m -62.06 -43.84 97.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.033 0.444 . . . . 0.0 109.876 176.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -59.67 -51.08 71.32 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.98 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 32.4 m -59.37 -44.97 92.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.686 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.5 HD12 ' HB2' ' A' 3599 ' ' PHE . 48.0 tp -62.38 -43.34 99.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.917 -178.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.516 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 55.4 mtmt -59.68 -51.73 68.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.624 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -69.77 -33.63 72.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.291 -175.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -95.45 -46.78 6.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -171.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.5 ' HB2' HD12 ' A' 3595 ' ' LEU . 27.3 m-85 -100.3 -51.03 3.75 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 -174.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.516 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.9 mm -62.38 -60.54 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.359 -173.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 88.0 m -58.0 -39.71 78.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.394 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.438 ' HE1' HD11 ' B' 2521 ' ' LEU . 45.6 t80 -71.74 -56.15 6.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.529 -176.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' 3608 ' ' ALA . 0.3 OUTLIER -56.24 -39.81 73.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.726 -0.216 . . . . 0.0 111.329 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -75.88 -30.52 58.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.766 0.317 . . . . 0.0 110.297 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -65.79 -38.69 89.7 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.408 0.623 . . . . 0.0 110.248 176.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -79.5 -18.9 50.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.953 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . 0.443 ' O ' ' HG ' ' A' 3555 ' ' LEU . 52.5 mt-30 51.26 51.11 17.6 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -170.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.553 ' O ' HD12 ' A' 3603 ' ' LEU . . . -133.23 -177.68 4.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.739 -174.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.792 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -117.7 118.33 31.8 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.131 176.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . 0.511 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.2 104.18 0.85 Allowed Glycine 0 C--O 1.223 -0.548 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.492 178.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.666 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 37.3 mm -90.0 123.36 42.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.188 0.518 . . . . 0.0 110.95 -175.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.733 HD13 ' HB3' ' A' 3547 ' ' LEU . 40.6 mt -118.52 105.96 18.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.83 175.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.465 ' HA ' ' O ' ' A' 3624 ' ' TYR . 11.7 m120 -84.74 109.33 17.97 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.233 178.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.508 HG21 ' HD3' ' A' 3539 ' ' PRO . 10.7 p . . . . . 0 C--N 1.314 -0.975 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.982 -172.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.465 ' O ' ' HA ' ' A' 3613 ' ' ASN . 70.7 m-85 . . . . . 0 N--CA 1.452 -0.367 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.443 HG13 HD12 ' A' 3611 ' ' ILE . 4.1 t -117.14 115.64 49.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.166 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.635 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -99.31 112.96 25.02 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 170.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.429 ' O ' ' HA ' ' A' 3659 ' ' ILE . 13.5 mt-30 -94.16 111.06 22.76 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.664 -177.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.608 HG12 HG12 ' A' 3659 ' ' ILE . 47.3 mt -93.97 99.46 9.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.548 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -91.17 138.49 25.79 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.451 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.34 168.32 22.65 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.786 2.324 . . . . 0.0 111.677 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -64.81 81.52 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.805 2.337 . . . . 0.0 112.243 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 7.9 p -111.84 162.08 15.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.017 -176.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . 0.503 ' CD ' ' H ' ' A' 3633 ' ' GLU . 1.7 mp0 -54.72 -37.84 66.35 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.151 -179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . 0.433 ' CE2' ' HB3' ' A' 3560 ' ' LEU . 31.9 t80 -65.87 -42.78 89.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.097 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 67.1 p -62.86 -54.08 44.27 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.968 -178.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' 3633 ' ' GLU . 0.6 OUTLIER -59.55 -38.14 80.29 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.643 0.258 . . . . 0.0 111.375 -179.364 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 48.1 t -56.71 -53.19 60.63 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.816 178.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -74.3 -30.57 62.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.949 -178.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . 0.472 ' HB3' HD23 ' A' 3647 ' ' LEU . 49.2 mt -62.53 -39.64 94.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.444 0.164 . . . . 0.0 110.891 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.537 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 24.3 m -63.97 -39.66 94.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.198 0.523 . . . . 0.0 110.54 177.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -72.07 -43.4 64.94 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.675 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.759 HD13 HD22 ' A' 3575 ' ' LEU . 20.0 mt -83.5 -42.03 17.33 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.442 -173.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.437 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -142.63 83.5 11.7 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.828 0.347 . . . . 0.0 111.438 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.73 -26.03 28.14 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.666 2.244 . . . . 0.0 113.307 -175.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 5.6 t0 -71.84 -47.83 50.38 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -173.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.628 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.03 -29.37 49.35 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.359 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.537 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.14 -51.58 63.81 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.892 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.03 -25.4 66.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.933 0.397 . . . . 0.0 111.136 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 17.6 m -79.36 -36.35 39.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.029 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.573 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.4 pt -81.42 -10.44 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.237 0 CA-C-O 120.755 0.312 . . . . 0.0 111.349 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 9.4 t -59.08 -26.53 64.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.142 0.496 . . . . 0.0 109.701 174.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 13.9 m120 -79.68 -41.21 27.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.326 0.584 . . . . 0.0 110.111 175.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.573 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.6 tp -105.29 40.32 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 122.22 1.01 . . . . 0.0 109.821 -177.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.5 ' N ' ' HD2' ' A' 3655 ' ' PRO . 50.8 m -40.43 -40.61 2.08 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-N 114.521 -1.218 . . . . 0.0 113.6 173.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' 3654 ' ' SER . 14.9 Cg_endo -60.24 78.57 0.07 OUTLIER 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 121.568 1.512 . . . . 0.0 111.864 169.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . 0.43 ' CB ' HD23 ' A' 3579 ' ' LEU . 32.6 p80 -150.46 -178.64 6.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.636 -179.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.482 ' HB3' HG23 ' A' 3628 ' ' ILE . 24.0 mt -124.74 142.59 51.3 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.71 -178.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 61.2 ttp -102.69 110.99 23.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.842 HD12 HD21 ' A' 3524 ' ' LEU . 84.0 mt -103.88 121.29 55.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-O 121.306 0.574 . . . . 0.0 111.492 -173.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.731 HG13 ' HD2' ' A' 3573 ' ' TYR . 85.1 t -107.27 116.4 50.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.661 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.643 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 64.3 mt -90.81 112.19 24.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 177.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -108.52 128.52 54.88 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.881 0.372 . . . . 0.0 111.322 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 9.2 m -68.95 114.63 7.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.005 174.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 63.2 t . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.914 -0.565 . . . . 0.0 110.155 179.196 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.572 ' CE1' ' HG3' ' A' 3553 ' ' MET . 8.0 m-85 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 111.172 0.064 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.596 ' HG2' ' H ' ' B' 2520 ' ' THR . 15.7 tt0 57.01 -158.74 0.26 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 177.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.667 ' HA ' ' HA ' ' A' 3551 ' ' GLN . 8.0 t -157.44 124.55 5.13 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 172.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.664 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.448 -0.556 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.611 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.3 pp . . . . . 0 CA--C 1.528 0.111 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.666 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -71.82 -13.65 61.75 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.429 -173.301 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.543 ' N ' HD13 ' A' 3502 ' ' LEU . 51.4 tptt -67.64 -23.7 65.37 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 174.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 36.0 mmtm -103.27 -42.66 5.67 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.261 176.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.684 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -146.87 103.08 3.88 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-O 121.471 0.653 . . . . 0.0 110.796 179.252 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . 0.666 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 94.0 Cg_endo -82.11 174.39 10.1 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 123.972 3.115 . . . . 0.0 113.556 -176.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.518 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 82.1 mt -71.22 133.12 32.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.536 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.475 HG13 ' HB2' ' A' 3526 ' ' PHE . 33.8 m -101.89 -24.55 4.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.364 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.638 ' HB2' HD13 ' A' 3538 ' ' LEU . 50.4 t-105 -156.13 154.73 31.34 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.805 0.336 . . . . 0.0 110.786 -176.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -147.57 120.08 8.5 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -171.1 -132.92 1.54 Allowed Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.723 -177.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.574 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -139.83 149.0 42.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.182 0.515 . . . . 0.0 111.546 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.486 HD23 ' HB2' ' A' 3547 ' ' LEU . 93.8 mt -105.1 144.38 31.97 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 170.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.696 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -141.98 124.44 15.74 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.738 0.304 . . . . 0.0 111.61 -177.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.67 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.31 146.37 44.54 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 173.903 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.67 ' CD ' HD12 ' A' 3515 ' ' LEU . 1.2 mptm? 62.64 -93.69 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -167.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 22.4 m120 -147.26 11.95 1.04 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.343 175.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' 3514 ' ' ALA . 3.9 t0 -100.09 138.72 36.78 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.129 -175.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.615 HG22 ' HB2' ' A' 3514 ' ' ALA . 28.0 p -123.58 127.69 48.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.087 0.47 . . . . 0.0 111.88 -175.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -120.71 115.64 23.72 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.395 175.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.574 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.75 120.78 18.85 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.429 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -130.38 147.93 33.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.538 0.685 . . . . 0.0 111.834 -175.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -111.1 126.09 54.46 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.986 173.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.938 HD21 HD12 ' A' 3659 ' ' ILE . 0.8 OUTLIER -95.51 112.63 24.31 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.34 0.59 . . . . 0.0 111.986 -173.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.518 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 74.9 m-70 -85.53 140.28 30.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.757 174.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.684 ' O ' ' HB2' ' A' 3505 ' ' TYR . 58.9 t80 -70.17 136.64 50.28 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 175.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.598 ' CG1' HD23 ' A' 3575 ' ' LEU . 19.6 t -115.36 -51.96 4.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.081 0.467 . . . . 0.0 111.372 178.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 25.8 t -162.19 170.39 19.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.706 -170.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.25 -149.21 21.19 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.854 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.544 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.5 t-20 -104.7 117.02 33.05 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.773 0.32 . . . . 0.0 110.713 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 12.2 p30 -61.15 -36.28 79.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . 0.446 HG12 ' HD2' ' A' 3536 ' ' ARG . 57.8 t -59.95 -33.41 52.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.559 0.218 . . . . 0.0 110.489 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.54 HD23 ' HD3' ' A' 3536 ' ' ARG . 16.4 mt -56.7 -40.99 76.6 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.235 178.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.453 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.81 -47.26 72.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.885 0.374 . . . . 0.0 110.378 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -59.89 -35.59 75.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.946 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.54 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.4 ptm180 -88.95 -11.09 45.37 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.523 ' O ' HG21 ' A' 3614 ' ' VAL . 57.5 p -103.05 -37.52 7.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.976 0.417 . . . . 0.0 111.227 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.638 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.3 mt -78.88 112.01 24.14 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -174.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo . . . . . 0 N--CA 1.461 -0.403 0 C-N-CA 123.255 2.636 . . . . 0.0 113.989 -166.718 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo . . . . . 0 N--CA 1.463 -0.278 0 CA-C-O 120.996 0.332 . . . . 0.0 112.614 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.707 ' HB3' HD13 ' A' 3612 ' ' ILE . 57.0 mt -78.0 118.05 19.91 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.264 177.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.696 ' HA ' ' O ' ' A' 3514 ' ' ALA . 23.8 ptt180 -103.52 141.62 35.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.074 0.464 . . . . 0.0 111.401 -177.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.481 HD12 HD22 ' A' 3515 ' ' LEU . 19.5 mt -94.12 107.23 19.04 Favored 'Isoleucine or valine' 0 C--O 1.254 1.326 0 CA-C-O 122.705 1.24 . . . . 0.0 111.648 -172.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.468 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -108.94 -6.52 15.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.891 -173.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.686 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 52.6 mt-30 -148.29 176.95 9.83 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.363 0.125 . . . . 0.0 111.142 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -155.83 136.79 13.62 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.884 0.374 . . . . 0.0 111.585 -178.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.603 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 14.1 tmm? -110.39 121.67 45.85 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.398 177.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -71.78 110.64 6.45 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.549 ' HB2' HD21 ' A' 3560 ' ' LEU . 2.9 pp -71.98 98.65 2.09 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 122.278 1.037 . . . . 0.0 110.054 -176.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.612 ' O ' ' HG ' ' A' 3560 ' ' LEU . 43.4 mt-10 -113.09 166.42 11.45 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.309 176.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -53.24 -47.48 68.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.063 0.459 . . . . 0.0 111.11 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 1.6 p -63.04 -38.39 91.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.507 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.891 HE21 ' HA ' ' A' 3559 ' ' GLN . 0.0 OUTLIER -74.27 -37.59 63.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.168 -177.521 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' 3556 ' ' GLU . 86.0 mt -61.72 -35.32 77.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.729 0.3 . . . . 0.0 110.488 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -62.85 -46.17 89.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.961 173.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -62.32 -34.07 88.1 Favored Glycine 0 CA--C 1.519 0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.499 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.565 ' O ' ' HG3' ' A' 3567 ' ' MET . 59.2 t -66.87 -49.5 73.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . 0.566 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.74 -27.54 68.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.063 178.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -54.76 -47.34 74.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.533 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.2 ptp85 -85.17 -14.41 47.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.078 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.566 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 87.6 mtp -83.08 -19.58 36.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.804 0.335 . . . . 0.0 111.153 -179.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . 0.43 HG23 ' O ' ' A' 3564 ' ' ALA . 37.0 p -80.36 -21.45 42.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.144 0.497 . . . . 0.0 110.549 177.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 23.3 t -106.19 78.65 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.572 177.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.66 108.21 1.99 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.665 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.544 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.7 m 155.96 -45.85 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.373 1.469 . . . . 0.0 107.732 -173.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -86.76 -14.86 41.11 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.295 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.656 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -134.81 162.88 31.12 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.758 175.475 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.622 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 34.2 t -128.23 133.94 48.92 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.783 HD22 HD13 ' A' 3642 ' ' LEU . 12.6 tp -105.61 125.41 50.96 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.588 HD11 HD11 ' A' 3661 ' ' ILE . 81.4 mt -125.78 154.52 42.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.85 -177.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.722 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.72 108.14 13.62 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.186 179.76 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.451 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.28 123.64 37.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.236 0.541 . . . . 0.0 110.591 -178.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.414 HD23 ' HB2' ' A' 3656 ' ' HIS . 73.7 mt -124.63 143.71 44.22 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.258 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.47 117.96 4.78 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.46 2.107 . . . . 0.0 112.21 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.7 p -110.08 119.62 39.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.127 0.489 . . . . 0.0 110.029 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -102.82 145.19 16.27 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.735 -177.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 44.3 mtm180 -70.52 -25.18 63.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.782 0.801 . . . . 0.0 109.87 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.576 ' O ' HG23 ' A' 3588 ' ' VAL . 23.9 t70 -147.9 169.95 18.72 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.354 -1.294 . . . . 0.0 108.257 -175.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.53 -49.59 67.3 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -60.93 -37.96 84.14 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.688 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.556 ' HB3' ' H ' ' A' 3584 ' ' ASP . 6.4 t70 -66.97 -40.83 87.53 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.548 -177.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' 3584 ' ' ASP . 94.1 t -58.68 -39.49 76.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.178 0.514 . . . . 0.0 110.385 178.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 3.0 t -63.49 -48.27 87.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.457 177.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 71.9 m -58.72 -47.31 85.02 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 114.178 -1.374 . . . . 0.0 111.703 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' 3587 ' ' ASP . 71.6 mm-40 -63.87 -45.08 91.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.478 0.18 . . . . 0.0 110.758 -179.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 46.3 m -57.59 -47.4 82.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.16 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.42 ' HA ' ' HE3' ' A' 3596 ' ' LYS . 9.5 tp10 -60.91 -50.7 72.37 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.887 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 19.4 m -60.65 -45.25 94.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.187 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.529 HD12 ' HB2' ' A' 3599 ' ' PHE . 44.8 tp -64.08 -45.93 86.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.568 -175.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.785 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -71.29 -25.55 62.49 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.061 -176.164 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.55 -40.56 18.96 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.403 178.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.493 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -92.36 -45.97 7.92 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -171.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.529 ' HB2' HD12 ' A' 3595 ' ' LEU . 21.1 m-85 -98.47 -50.17 4.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.256 -174.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.785 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 21.8 mm -61.46 -58.09 9.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.738 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 98.0 m -55.57 -41.06 72.77 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 123.352 0.407 . . . . 0.0 111.456 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.749 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -68.48 -56.98 6.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.614 -0.267 . . . . 0.0 111.333 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.749 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.52 -43.55 79.89 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.526 0.203 . . . . 0.0 111.521 -177.182 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -68.07 -37.29 81.1 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.496 -177.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.25 -37.3 77.88 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.038 0.447 . . . . 0.0 110.822 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -77.35 -18.6 57.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.824 179.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 50.03 53.03 13.54 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -169.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.52 ' O ' HD12 ' A' 3603 ' ' LEU . . . -135.69 -176.02 4.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.312 -171.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.05 118.26 30.15 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.499 176.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . 0.424 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.93 103.78 0.84 Allowed Glycine 0 C--O 1.222 -0.605 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.485 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.686 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 31.0 mm -88.99 120.37 37.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.175 0.512 . . . . 0.0 111.055 -174.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.707 HD13 ' HB3' ' A' 3547 ' ' LEU . 35.0 mt -119.24 117.83 55.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.879 176.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.542 ' HA ' ' O ' ' A' 3624 ' ' TYR . 15.9 m120 -96.73 126.04 41.62 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.348 -178.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.646 HG22 ' HB2' ' A' 3624 ' ' TYR . 3.4 m . . . . . 0 C--N 1.32 -0.691 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 176.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.646 ' HB2' HG22 ' A' 3614 ' ' VAL . 19.5 m-85 . . . . . 0 CA--C 1.513 -0.451 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 10.7 t -117.76 114.12 44.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.555 177.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.62 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -99.36 111.19 23.6 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 169.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.547 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 40.5 mt-30 -93.85 111.76 23.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.928 -178.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.596 HG12 HG12 ' A' 3659 ' ' ILE . 42.1 mt -89.14 98.05 7.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.166 178.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -87.48 141.94 32.69 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.86 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.514 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 53.4 Cg_endo -69.3 172.96 11.27 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 122.656 2.237 . . . . 0.0 111.513 176.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.88 40.36 0.42 Allowed 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.801 2.334 . . . . 0.0 112.571 176.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 22.6 p -72.05 161.63 30.62 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.852 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -51.2 -39.58 56.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.003 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 33.9 t80 -50.76 -53.88 28.03 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.04 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 5.6 m -62.72 -56.81 14.24 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.92 -177.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.45 -41.81 69.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.881 -175.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 21.3 m -67.46 -47.89 68.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.128 -176.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -64.24 -35.77 81.9 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.271 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.22 -34.16 77.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.962 176.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.677 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 37.7 m -67.02 -29.63 69.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.76 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.59 -56.45 3.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.166 176.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.783 HD13 HD22 ' A' 3575 ' ' LEU . 19.2 mt -66.04 -38.5 88.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.342 -171.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.432 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -144.81 74.57 14.74 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.834 -0.166 . . . . 0.0 111.385 -178.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -67.76 -19.21 47.5 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.393 2.062 . . . . 0.0 111.74 -178.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . 0.567 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.5 m-20 -73.5 -51.58 16.6 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.004 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.722 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -77.85 -30.09 50.82 Favored 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -179.58 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.677 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -53.82 -47.34 70.97 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.33 177.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.55 -28.95 68.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.058 0.456 . . . . 0.0 111.148 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 20.1 m -81.44 -33.34 32.16 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.041 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.622 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.8 pt -83.95 -10.44 11.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.235 -178.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 38.4 m -55.36 -33.61 63.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.361 176.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -84.0 -33.01 24.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.647 179.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.622 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.5 tp -105.43 38.31 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 122.41 1.1 . . . . 0.0 109.335 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.488 ' N ' ' HD2' ' A' 3655 ' ' PRO . 22.9 t -39.27 -40.84 1.39 Allowed Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 113.996 -1.456 . . . . 0.0 113.606 173.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' 3654 ' ' SER . 17.6 Cg_endo -60.21 80.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 121.647 1.565 . . . . 0.0 111.597 168.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . 0.414 ' HB2' HD23 ' A' 3579 ' ' LEU . 21.7 p80 -146.72 177.14 9.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.687 -177.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.462 HD22 HG22 ' A' 3628 ' ' ILE . 39.1 mt -122.41 146.93 46.9 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.278 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 61.6 ttp -109.05 107.28 17.55 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 174.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.938 HD12 HD21 ' A' 3524 ' ' LEU . 81.2 mt -99.05 116.35 41.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.295 0.569 . . . . 0.0 111.218 -172.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.656 HG13 ' HD2' ' A' 3573 ' ' TYR . 94.0 t -103.07 113.91 41.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.993 -177.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.622 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 62.7 mt -90.56 122.15 41.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.154 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -116.89 127.94 54.76 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.354 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 5.2 p -93.13 131.98 37.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.097 0.475 . . . . 0.0 110.868 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 30.6 t . . . . . 0 C--O 1.244 0.812 0 CA-C-O 118.785 -0.626 . . . . 0.0 110.021 179.231 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.603 ' CD1' ' HB2' ' A' 3553 ' ' MET . 24.5 m-85 . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 111.223 0.083 . . . . 0.0 111.223 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.502 ' CB ' ' HG2' ' A' 3552 ' ' ARG . 0.4 OUTLIER 54.96 -162.04 0.15 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.613 0.721 . . . . 0.0 111.704 177.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.498 ' HA ' ' HG2' ' A' 3551 ' ' GLN . 18.7 m -147.3 123.53 10.88 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 168.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.468 ' H ' ' C ' ' A' 3550 ' ' ALA . 34.9 tp . . . . . 0 CA--C 1.512 -0.517 0 C-N-CA 119.54 -0.864 . . . . 0.0 109.956 179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.521 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp . . . . . 0 CA--C 1.528 0.101 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.614 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.46 -15.73 62.85 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.683 -172.071 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.614 ' N ' HD13 ' A' 3502 ' ' LEU . 18.6 tptm -74.58 -16.3 60.81 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 44.3 mmtm -105.23 -43.11 5.09 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.818 173.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.729 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.68 102.48 3.45 Favored Pre-proline 0 N--CA 1.447 -0.614 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.24 -178.759 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -85.97 174.25 6.5 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 124.347 3.365 . . . . 0.0 113.602 -178.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.56 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 97.6 mt -71.98 137.18 24.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.938 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 29.6 m -104.24 -24.75 3.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.654 -178.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.634 ' CB ' HD13 ' A' 3538 ' ' LEU . 39.2 t90 -158.22 152.6 24.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.38 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . 0.445 ' HG3' ' HB3' ' A' 3523 ' ' GLN . 26.2 tt0 -148.2 119.94 8.08 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -166.54 -128.72 1.0 Allowed Glycine 0 N--CA 1.442 -0.948 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -178.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.7 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.0 mp -139.18 156.63 46.97 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.161 0.505 . . . . 0.0 111.101 178.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.491 HD23 ' HB2' ' A' 3547 ' ' LEU . 72.7 mt -109.48 151.67 26.41 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 169.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.781 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.76 124.04 13.0 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.698 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.702 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.08 142.9 38.14 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 171.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.702 ' HD3' HD12 ' A' 3515 ' ' LEU . 2.0 mptp? 63.79 -95.01 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -169.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . 0.412 HD22 ' HA ' ' A' 3517 ' ' ASN . 7.0 m120 -143.38 9.65 1.64 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.007 -0.997 . . . . 0.0 108.73 175.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.466 ' O ' ' HA ' ' A' 3514 ' ' ALA . 13.4 m-20 -94.89 128.75 41.89 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.164 -175.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.482 HG22 ' HB2' ' A' 3514 ' ' ALA . 29.0 p -118.45 134.48 55.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.059 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -129.04 116.37 19.2 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.619 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.48 119.59 14.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.933 0.397 . . . . 0.0 109.955 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' 3579 ' ' LEU . 28.0 m -128.08 147.55 32.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.664 0.745 . . . . 0.0 111.867 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . 0.445 ' HB3' ' HG3' ' A' 3510 ' ' GLN . 4.4 pt20 -112.29 125.17 53.88 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.599 -1.182 . . . . 0.0 108.58 173.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.827 HD21 HD12 ' A' 3659 ' ' ILE . 0.7 OUTLIER -96.89 112.34 24.14 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.278 0.561 . . . . 0.0 111.851 -174.773 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.56 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 73.5 m-70 -82.98 138.69 33.68 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.113 -0.948 . . . . 0.0 108.646 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.729 ' O ' ' HB2' ' A' 3505 ' ' TYR . 68.5 t80 -66.41 136.34 55.61 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 173.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.566 ' CG1' HD23 ' A' 3575 ' ' LEU . 18.9 t -115.2 -54.56 4.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 121.247 0.546 . . . . 0.0 110.931 177.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.411 ' OG ' HD22 ' A' 3642 ' ' LEU . 28.7 t -159.1 170.42 22.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.124 -169.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.11 -147.11 20.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.23 174.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' A' 3571 ' ' THR . 41.9 t30 -107.6 108.97 20.48 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -63.17 -26.66 68.91 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.706 -175.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 47.4 t -59.27 -32.31 48.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.636 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.518 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 25.2 mt -57.8 -44.6 86.44 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.009 177.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -65.0 -42.19 94.69 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 120.765 0.317 . . . . 0.0 110.642 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -58.34 -41.57 84.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.695 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -89.98 -4.95 57.17 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . . . . . . . . . 13.3 p -104.43 -40.68 5.98 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.891 -0.506 . . . . 0.0 111.514 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.634 HD13 ' CB ' ' A' 3509 ' ' TRP . 22.9 mt -80.32 115.68 56.46 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-O 121.208 0.528 . . . . 0.0 110.874 -172.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . 0.44 ' HD3' HG21 ' A' 3614 ' ' VAL . 58.6 Cg_endo . . . . . 0 N--CA 1.46 -0.494 0 C-N-CA 123.03 2.487 . . . . 0.0 112.979 -176.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . 0.7 ' HA ' ' O ' ' A' 3512 ' ' LEU . 56.4 Cg_endo . . . . . 0 N--CA 1.454 -0.824 0 CA-C-O 121.094 0.372 . . . . 0.0 112.76 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.693 ' HB3' HD13 ' A' 3612 ' ' ILE . 37.1 mt -68.3 109.69 3.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.218 174.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.781 ' HA ' ' O ' ' A' 3514 ' ' ALA . 14.9 ptt180 -96.1 139.73 31.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.358 0.599 . . . . 0.0 111.48 -173.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.47 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.8 mt -93.82 107.81 19.75 Favored 'Isoleucine or valine' 0 C--O 1.245 0.848 0 CA-C-O 122.037 0.922 . . . . 0.0 111.603 -172.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.523 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -116.85 5.37 13.0 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.363 -175.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.709 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 42.3 mt-30 -149.4 165.82 30.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.391 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.691 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -155.09 138.31 15.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 0.0 110.923 -179.783 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.555 ' HG3' ' CE2' ' B' 2518 ' ' TYR . 13.7 tmm? -111.25 121.54 45.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.5 177.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -63.01 109.88 1.62 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.631 ' O ' HD12 ' A' 3555 ' ' LEU . 3.4 pp -70.06 99.16 1.41 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 122.5 1.143 . . . . 0.0 109.703 -177.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' 3560 ' ' LEU . 8.4 mm-40 -104.91 152.39 22.71 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.291 178.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.576 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -53.25 -48.23 68.4 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 175.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 22.2 m -58.08 -43.84 87.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.597 176.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.551 ' O ' HG23 ' A' 3563 ' ' VAL . 12.1 mm100 -66.06 -45.7 80.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.999 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' 3556 ' ' GLU . 94.0 mt -62.88 -36.38 83.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.447 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' 3557 ' ' ALA . 8.7 mm-40 -56.19 -51.19 68.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.39 172.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -60.9 -41.73 99.4 Favored Glycine 0 CA--C 1.521 0.431 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.548 178.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' 3559 ' ' GLN . 63.1 t -62.6 -48.88 86.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.882 0.372 . . . . 0.0 110.456 177.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.78 -30.92 69.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.71 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.516 ' O ' ' HB ' ' A' 3568 ' ' THR . 34.5 ttm180 -60.53 -40.65 92.26 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.741 0.305 . . . . 0.0 111.192 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -86.6 -10.01 54.84 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.335 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' 3563 ' ' VAL . 83.1 mtp -83.25 -20.51 34.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.961 0.886 . . . . 0.0 108.969 171.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' 3565 ' ' ARG . 23.2 m -75.5 -15.54 60.39 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 114.174 -1.376 . . . . 0.0 110.26 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 47.7 t -116.45 90.09 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.987 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.39 108.26 4.17 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.527 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 153.26 -45.48 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 O-C-N 125.057 1.473 . . . . 0.0 107.98 -174.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.08 -30.71 58.42 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.602 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.768 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -126.76 165.79 18.62 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.392 179.269 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.629 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 51.2 t -127.42 134.53 49.88 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 171.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.835 HD22 HD13 ' A' 3642 ' ' LEU . 15.2 tp -105.56 126.91 52.68 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.635 HD11 HD11 ' A' 3661 ' ' ILE . 76.9 mt -125.9 154.51 42.65 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.149 0.5 . . . . 0.0 110.934 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.729 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -121.55 108.33 13.48 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.074 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.526 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 123.33 37.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.365 0.602 . . . . 0.0 110.748 -177.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.419 HD23 ' HB2' ' A' 3656 ' ' HIS . 85.5 mt -123.35 143.59 41.64 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.943 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . 0.411 ' HA ' ' O ' ' A' 3521 ' ' ALA . 21.5 Cg_endo -61.8 110.99 1.07 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.341 2.028 . . . . 0.0 112.038 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.4 p -95.97 114.33 26.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.337 0.589 . . . . 0.0 110.532 -178.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.93 145.9 16.22 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.542 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' 3583 ' ' ARG . 34.1 ttp180 -60.19 -47.69 84.88 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 123.728 0.811 . . . . 0.0 110.73 175.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.56 ' O ' HG23 ' A' 3588 ' ' VAL . 2.2 p30 -134.92 179.78 6.1 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.3 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -54.98 -46.65 75.12 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.246 0.341 . . . . 0.0 111.57 -175.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -67.31 -40.82 86.05 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.44 ' HB3' ' H ' ' A' 3584 ' ' ASP . 19.5 t70 -60.61 -42.53 97.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.289 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' 3584 ' ' ASP . 81.1 t -57.46 -49.26 80.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.368 176.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . 0.438 ' O ' ' HG2' ' A' 3593 ' ' GLU . 93.7 t -59.66 -49.37 83.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.369 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 29.7 t -59.43 -43.2 93.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.24 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -68.9 -36.09 77.62 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.841 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 88.5 m -63.01 -54.29 40.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.857 0.36 . . . . 0.0 110.78 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.9 pt-20 -62.88 -34.68 77.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.32 -178.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 50.6 m -70.22 -42.09 72.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.647 0.261 . . . . 0.0 110.721 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.594 HD12 ' HB2' ' A' 3599 ' ' PHE . 58.8 tp -63.15 -45.48 91.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.999 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.821 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 21.2 ptmt -67.51 -29.82 69.33 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.657 -0.417 . . . . 0.0 111.161 -178.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -80.97 -40.78 23.87 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.745 0.307 . . . . 0.0 111.656 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -90.71 -46.54 8.19 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -171.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.594 ' HB2' HD12 ' A' 3595 ' ' LEU . 9.5 m-85 -98.34 -50.01 4.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.719 0.295 . . . . 0.0 111.323 -174.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.821 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 25.6 mm -60.66 -55.03 27.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.721 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 73.3 m -56.27 -39.79 73.18 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 123.295 0.372 . . . . 0.0 110.977 179.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.79 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -66.68 -57.65 6.73 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.063 179.008 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.79 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.93 -41.25 77.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 -177.704 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -37.1 67.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.698 -177.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.16 -33.88 72.32 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.973 0.416 . . . . 0.0 110.848 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -81.16 -19.04 44.26 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.837 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . 0.452 ' O ' ' HG ' ' A' 3555 ' ' LEU . 89.8 mt-30 46.31 61.32 2.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.376 0.608 . . . . 0.0 109.582 -168.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.503 ' O ' HD12 ' A' 3603 ' ' LEU . . . -137.84 -177.68 4.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.588 -173.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.691 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -118.19 117.89 30.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.212 173.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.02 101.14 0.45 Allowed Glycine 0 C--O 1.223 -0.571 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.709 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 31.4 mm -89.4 127.7 41.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 121.264 0.554 . . . . 0.0 110.977 -173.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.693 HD13 ' HB3' ' A' 3547 ' ' LEU . 71.5 mt -128.7 105.1 12.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.025 -0.989 . . . . 0.0 109.961 177.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.575 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.6 m120 -81.0 116.84 21.16 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 172.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.44 HG21 ' HD3' ' A' 3539 ' ' PRO . 8.0 p . . . . . 0 C--N 1.309 -1.16 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.42 -176.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.575 ' O ' ' HA ' ' A' 3613 ' ' ASN . 92.3 m-85 . . . . . 0 N--CA 1.446 -0.654 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.424 HG13 HG23 ' A' 3611 ' ' ILE . 3.3 t -120.51 113.66 40.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.766 176.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.626 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.3 mp -94.98 112.25 23.97 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 171.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.458 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 36.8 mt-30 -93.99 110.71 22.38 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.299 -178.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.579 HG12 HG12 ' A' 3659 ' ' ILE . 48.0 mt -90.3 97.86 7.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.954 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -89.13 143.13 30.68 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.823 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.53 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 48.5 Cg_endo -69.12 169.26 18.5 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.305 2.004 . . . . 0.0 111.039 175.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -68.64 55.16 0.85 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.115 2.544 . . . . 0.0 112.433 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . 0.44 ' O ' ' HG2' ' A' 3636 ' ' GLU . 8.5 p -83.22 162.32 21.25 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.748 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.06 -42.3 76.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.355 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 19.9 t80 -60.41 -40.05 89.62 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.864 0.364 . . . . 0.0 110.272 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 12.4 t -61.33 -59.1 5.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.637 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' 3632 ' ' CYS . 7.9 mm-40 -65.19 -34.0 77.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.297 -173.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 30.6 t -65.25 -48.72 72.29 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.908 0.385 . . . . 0.0 110.264 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -67.21 -32.02 72.8 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.353 178.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . 0.484 ' HB3' HD23 ' A' 3647 ' ' LEU . 65.0 mt -63.16 -40.32 97.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.899 175.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.63 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 38.0 m -63.83 -31.82 73.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.362 0.601 . . . . 0.0 110.153 178.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -80.11 -45.97 17.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.014 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.835 HD13 HD22 ' A' 3575 ' ' LEU . 19.5 mt -82.37 -35.0 28.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.564 -0.744 . . . . 0.0 112.449 -172.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.422 ' HB3' HG13 ' A' 3527 ' ' VAL . . . -147.86 82.57 7.83 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.86 0.362 . . . . 0.0 111.124 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.23 -26.9 48.92 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.804 2.336 . . . . 0.0 113.377 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 8.0 t70 -75.34 -52.12 11.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.096 0.474 . . . . 0.0 110.197 -173.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.729 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -71.14 -29.31 65.07 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.598 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.63 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -55.26 -52.24 64.03 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.811 0.338 . . . . 0.0 110.622 178.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.79 -28.61 68.88 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.042 0.449 . . . . 0.0 110.682 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 20.3 m -76.79 -35.19 57.8 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.114 179.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.582 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.4 pt -83.07 -9.92 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.413 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.5 m -63.85 -16.38 61.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.214 0.53 . . . . 0.0 110.114 175.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 47.4 t30 -87.94 -38.72 15.34 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.904 173.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.582 HG22 ' HA ' ' A' 3650 ' ' ILE . 7.7 tp -105.25 41.08 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 122.527 1.156 . . . . 0.0 109.66 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.474 ' N ' ' HD2' ' A' 3655 ' ' PRO . 14.7 m -38.05 -43.06 1.52 Allowed Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 114.008 -1.451 . . . . 0.0 113.747 172.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' 3654 ' ' SER . 19.6 Cg_endo -61.27 77.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 121.631 1.554 . . . . 0.0 111.818 169.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . 0.419 ' HB2' HD23 ' A' 3579 ' ' LEU . 25.9 p80 -142.82 174.61 10.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.981 -177.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.486 HD22 HG22 ' A' 3628 ' ' ILE . 36.9 mt -120.63 142.05 49.79 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.301 178.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 13.3 tmm? -105.84 109.64 21.66 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.827 HD12 HD21 ' A' 3524 ' ' LEU . 74.6 mt -105.38 119.05 53.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.264 0.554 . . . . 0.0 111.499 -171.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.768 HG13 ' HD2' ' A' 3573 ' ' TYR . 81.0 t -102.68 116.6 46.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.686 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.635 HD11 HD11 ' A' 3576 ' ' LEU . 54.3 mt -90.53 111.86 24.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.49 128.14 56.34 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 120.97 0.414 . . . . 0.0 111.503 -177.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 8.5 m -74.06 142.11 45.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.714 171.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 84.1 t . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.418 -0.801 . . . . 0.0 109.612 175.452 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.555 ' CE2' ' HG3' ' A' 3553 ' ' MET . 1.5 m-85 . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 120.538 0.208 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.646 ' O ' ' HG2' ' A' 3551 ' ' GLN . 48.4 tt0 59.29 -175.6 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -177.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.403 ' H ' ' HG2' ' B' 2519 ' ' GLU . 6.2 p -140.59 123.83 16.71 Favored 'General case' 0 C--N 1.317 -0.831 0 O-C-N 121.795 -0.566 . . . . 0.0 110.211 178.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.523 ' H ' ' C ' ' A' 3550 ' ' ALA . 20.7 tp . . . . . 0 N--CA 1.452 -0.372 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.245 177.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.612 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.2 pp . . . . . 0 N--CA 1.457 -0.12 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.611 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.85 -15.46 62.64 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 120.049 -0.661 . . . . 0.0 110.023 -174.258 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.611 ' N ' HD13 ' A' 3502 ' ' LEU . 26.8 tptp -66.77 -33.53 75.83 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.882 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.409 ' HB3' ' CD2' ' A' 3505 ' ' TYR . 22.0 mttp -98.73 -43.72 6.68 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.141 0.496 . . . . 0.0 110.849 178.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.747 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -143.75 97.01 5.49 Favored Pre-proline 0 N--CA 1.441 -0.891 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.379 -176.489 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -81.85 174.17 10.51 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 124.045 3.163 . . . . 0.0 113.533 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.463 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 74.3 mt -71.33 135.79 27.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.647 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.44 HG13 ' HB2' ' A' 3526 ' ' PHE . 32.8 m -109.04 -24.39 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.927 -176.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.716 ' HE3' HD12 ' A' 3524 ' ' LEU . 34.6 t90 -151.3 153.72 35.37 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.673 0.273 . . . . 0.0 110.362 -176.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -150.92 119.76 6.61 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -176.32 -134.02 1.88 Allowed Glycine 0 N--CA 1.445 -0.751 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -136.32 154.45 50.86 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.194 0.521 . . . . 0.0 111.334 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.483 HD23 ' HB2' ' A' 3547 ' ' LEU . 78.1 mt -107.45 152.76 23.78 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 170.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.696 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -148.29 123.64 10.29 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -177.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.614 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.81 143.46 38.91 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 173.117 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.614 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.4 OUTLIER 62.87 -94.97 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 -169.294 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -142.91 10.44 1.77 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 173.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.509 ' O ' ' HA ' ' A' 3514 ' ' ALA . 62.2 m-20 -91.88 128.31 37.68 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.55 -174.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.406 HG22 ' HB2' ' A' 3514 ' ' ALA . 11.9 p -119.13 137.74 53.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.337 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -137.26 118.69 14.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.458 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.626 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.96 124.84 26.25 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 177.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 29.5 m -134.4 147.61 29.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.609 0.718 . . . . 0.0 111.862 -175.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . 0.54 ' HG2' ' HB3' ' A' 3581 ' ' CYS . 9.1 pt20 -111.47 125.61 54.08 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.023 -0.99 . . . . 0.0 108.709 171.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.83 HD21 HD12 ' A' 3659 ' ' ILE . 2.2 mt -93.29 111.68 23.39 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.86 -175.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.463 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 68.2 m-70 -85.05 138.01 32.7 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.209 -0.905 . . . . 0.0 108.897 174.014 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.747 ' O ' ' HB2' ' A' 3505 ' ' TYR . 66.0 t80 -67.59 141.15 56.89 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 173.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.587 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.9 t -115.7 -54.91 4.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 121.387 0.613 . . . . 0.0 110.764 174.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.47 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 68.5 m -160.69 172.01 17.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.786 -171.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' 3570 ' ' GLU . . . 89.33 -151.11 21.75 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.298 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.565 ' HB2' ' HA ' ' A' 3571 ' ' THR . 39.7 t30 -108.26 117.6 34.58 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.597 0.237 . . . . 0.0 110.5 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.2 p30 -62.69 -29.14 70.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.4 -176.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . 0.434 ' HB ' HD21 ' A' 3530 ' ' ASN . 60.2 t -57.93 -34.75 49.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.37 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.423 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 34.2 mt -59.11 -46.22 88.88 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.466 ' HB1' HD12 ' A' 3538 ' ' LEU . . . -66.36 -41.34 89.63 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 120.84 0.352 . . . . 0.0 110.474 -177.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -60.43 -39.18 86.51 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.356 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -89.01 -17.74 28.78 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.487 ' HB2' HD11 ' A' 3626 ' ' LEU . 51.0 p -93.28 -41.61 9.78 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.966 -0.459 . . . . 0.0 110.788 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.684 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.4 mt -80.56 110.39 16.78 Favored Pre-proline 0 C--N 1.32 -0.677 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 -179.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo . . . . . 0 N--CA 1.456 -0.722 0 C-N-CA 122.554 2.169 . . . . 0.0 112.369 -176.918 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 21.5 Cg_exo . . . . . 0 C--O 1.236 0.379 0 N-CA-C 111.616 -0.186 . . . . 0.0 111.616 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.678 ' HB3' HD13 ' A' 3612 ' ' ILE . 19.7 mt -69.04 109.23 3.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.263 177.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.696 ' HA ' ' O ' ' A' 3514 ' ' ALA . 18.5 ptt180 -90.98 144.49 25.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.81 0.338 . . . . 0.0 110.902 -178.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.435 HG22 HD22 ' B' 2521 ' ' LEU . 19.6 mt -99.19 110.93 27.48 Favored 'Isoleucine or valine' 0 C--O 1.246 0.874 0 CA-C-O 121.848 0.832 . . . . 0.0 111.12 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.522 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -117.42 5.92 12.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.281 -174.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.669 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 58.9 mt-30 -152.89 170.26 20.79 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.386 0.136 . . . . 0.0 110.935 177.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.714 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -153.18 139.29 18.3 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.744 0.307 . . . . 0.0 111.528 -177.609 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.609 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.7 tmm? -116.88 111.65 19.96 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.839 176.082 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 75.9 mtm-85 -61.07 111.03 1.53 Allowed 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.425 ' O ' HD12 ' A' 3555 ' ' LEU . 1.8 pp -68.53 98.34 0.86 Allowed 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.071 0.939 . . . . 0.0 109.545 -176.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.607 ' O ' ' HG ' ' A' 3560 ' ' LEU . 13.0 mm-40 -109.62 164.35 12.61 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.643 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -53.34 -51.39 62.57 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.884 0.373 . . . . 0.0 111.447 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 21.0 p -65.42 -36.56 84.29 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.982 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.499 ' O ' HG23 ' A' 3563 ' ' VAL . 16.0 mm100 -64.91 -37.83 88.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.753 178.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' 3556 ' ' GLU . 86.4 mt -64.85 -31.33 72.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.648 179.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -67.12 -44.25 80.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.206 0.527 . . . . 0.0 110.098 173.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -56.16 -45.46 87.72 Favored Glycine 0 CA--C 1.518 0.225 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.819 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.576 ' O ' ' HG2' ' A' 3566 ' ' ARG . 60.0 t -62.55 -43.63 98.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 0.0 110.342 176.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -56.8 -39.87 74.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.26 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.61 ' O ' ' HB ' ' A' 3568 ' ' THR . 45.8 ttt180 -58.33 -44.11 88.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.678 0.275 . . . . 0.0 111.469 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . 0.576 ' HG2' ' O ' ' A' 3563 ' ' VAL . 5.7 ptp180 -76.69 -20.07 57.0 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.49 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.572 ' HG2' ' CE2' ' A' 3573 ' ' TYR . 81.3 mtp -84.61 -11.74 55.37 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.319 0.581 . . . . 0.0 109.964 175.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . 0.61 ' HB ' ' O ' ' A' 3565 ' ' ARG . 3.3 m -74.8 -23.93 58.57 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.171 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 60.6 t -126.58 101.27 7.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.257 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . 0.438 ' HB3' ' HA2' ' A' 3529 ' ' GLY . 44.9 mt-10 -75.72 109.0 8.95 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.565 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.2 m 148.55 -38.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.646 1.578 . . . . 0.0 107.287 -172.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.85 -27.53 40.12 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.238 176.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.746 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -131.36 164.0 26.63 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.064 176.237 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.641 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 47.7 t -127.74 135.43 50.13 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 171.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.731 HD22 HD13 ' A' 3642 ' ' LEU . 13.6 tp -104.67 125.66 51.0 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.578 HD11 HD11 ' A' 3661 ' ' ILE . 64.5 mt -126.18 158.2 36.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.245 0.545 . . . . 0.0 111.217 -176.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.54 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -126.13 107.93 10.86 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.699 178.79 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.508 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.83 123.04 38.06 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.251 0.548 . . . . 0.0 110.626 -177.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.438 HD21 HG22 ' A' 3650 ' ' ILE . 83.4 mt -123.02 142.56 38.48 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.299 -179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . 0.412 ' HA ' ' O ' ' A' 3521 ' ' ALA . 19.7 Cg_endo -61.87 112.11 1.4 Allowed 'Trans proline' 0 C--O 1.234 0.312 0 C-N-CA 122.382 2.055 . . . . 0.0 111.835 178.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . 0.54 ' HB3' ' HG2' ' A' 3523 ' ' GLN . 28.9 p -98.7 120.25 38.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.005 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . 0.469 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -97.52 142.69 16.29 Favored Glycine 0 N--CA 1.439 -1.111 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.536 -178.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 45.2 mtt85 -66.32 -31.42 72.2 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.037 0.922 . . . . 0.0 109.041 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.577 ' O ' HG23 ' A' 3588 ' ' VAL . 28.7 t70 -144.93 170.04 16.91 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.062 -1.426 . . . . 0.0 107.739 176.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -56.5 -38.11 71.31 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 118.203 0.456 . . . . 0.0 110.347 177.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -61.05 -46.72 89.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.383 0.611 . . . . 0.0 109.765 176.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.598 ' O ' ' HG2' ' A' 3591 ' ' GLN . 6.2 t70 -60.5 -44.75 95.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.173 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' 3584 ' ' ASP . 86.9 t -52.18 -41.37 33.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.104 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . 0.447 ' O ' ' HG2' ' A' 3593 ' ' GLU . 3.6 t -63.82 -52.32 58.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.685 0.755 . . . . 0.0 109.399 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 71.6 m -58.22 -43.83 87.91 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.116 -1.402 . . . . 0.0 111.977 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . 0.598 ' HG2' ' O ' ' A' 3587 ' ' ASP . 18.1 mm-40 -68.61 -41.31 79.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.038 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 83.2 m -61.45 -52.42 64.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.095 -178.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.1 pt-20 -67.23 -32.75 74.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.288 -178.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 28.1 t -64.78 -46.38 82.35 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 176.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.557 HD12 ' HB2' ' A' 3599 ' ' PHE . 52.0 tp -63.76 -46.2 86.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.231 -178.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.79 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.7 -29.26 69.78 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.493 -175.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . 0.457 ' O ' ' HB ' ' A' 3601 ' ' THR . . . -85.91 -42.38 14.13 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.908 0.385 . . . . 0.0 111.256 179.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.426 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -85.24 -45.85 11.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -170.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.557 ' HB2' HD12 ' A' 3595 ' ' LEU . 15.1 m-85 -99.34 -50.41 4.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.704 0.288 . . . . 0.0 111.18 -176.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.79 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 26.3 mm -61.38 -55.78 22.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.066 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . 0.457 ' HB ' ' O ' ' A' 3597 ' ' ALA . 74.4 m -60.43 -38.27 83.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.687 0.28 . . . . 0.0 111.221 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.775 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -67.05 -55.84 12.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.687 178.336 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.775 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.82 -41.98 78.8 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -178.354 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -70.74 -37.81 73.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.594 -177.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.13 -38.53 82.3 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 121.085 0.469 . . . . 0.0 110.626 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' 3602 ' ' TYR . 69.6 mmtt -77.5 -19.43 55.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.482 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 49.9 49.94 19.34 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.625 -169.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.523 ' O ' HD12 ' A' 3603 ' ' LEU . . . -128.5 -175.48 3.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.362 0.601 . . . . 0.0 112.169 -171.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.714 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.67 117.82 29.28 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.239 175.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.02 102.55 0.59 Allowed Glycine 0 C--O 1.221 -0.666 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 176.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.669 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.3 mm -89.21 121.4 39.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 121.204 0.526 . . . . 0.0 110.84 -174.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.678 HD13 ' HB3' ' A' 3547 ' ' LEU . 57.6 mt -117.87 105.38 17.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.444 175.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -87.41 115.32 24.74 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.867 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.314 -0.939 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.583 -177.127 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . . . . . . . . . 85.5 m-85 . . . . . 0 CA--C 1.513 -0.477 0 CA-C-O 121.134 0.492 . . . . 0.0 110.58 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 4.2 t -124.84 117.27 49.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.003 178.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.631 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -98.17 112.25 24.29 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 170.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.485 ' HB3' ' HB1' ' A' 3609 ' ' ALA . 34.0 mt-30 -94.72 110.47 22.31 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.658 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.588 HG12 HG12 ' A' 3659 ' ' ILE . 38.7 mt -92.14 98.06 7.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.027 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . 0.63 ' HB2' ' HE3' ' A' 3658 ' ' MET . 97.5 m-85 -89.78 147.67 38.11 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.764 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.449 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.8 Cg_endo -70.35 171.02 15.91 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.364 2.043 . . . . 0.0 111.134 175.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.37 42.04 0.45 Allowed 'Trans proline' 0 CA--C 1.532 0.425 0 C-N-CA 123.025 2.483 . . . . 0.0 112.603 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 24.8 p -72.56 163.36 28.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.151 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -44.95 -47.97 11.37 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 123.721 0.638 . . . . 0.0 110.937 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 26.6 t80 -48.95 -55.43 11.88 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.653 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . 0.49 ' HA ' ' HE2' ' A' 3658 ' ' MET . 19.7 m -56.58 -58.09 9.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.979 -177.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -60.81 -35.43 76.49 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.388 -174.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 66.4 m -57.34 -61.99 2.09 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.072 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -69.83 -20.36 63.44 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.143 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 62.8 mt -66.03 -35.97 81.99 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.364 174.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.803 ' HA ' HD22 ' A' 3647 ' ' LEU . 15.3 m -69.6 -35.31 75.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.321 0.581 . . . . 0.0 110.467 178.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -81.14 -37.79 28.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.058 -178.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.731 HD13 HD22 ' A' 3575 ' ' LEU . 15.7 mt -89.37 -31.11 17.93 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -174.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.433 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -153.0 72.53 7.11 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -176.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . 0.627 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 50.3 Cg_endo -70.87 -17.17 32.73 Favored 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 122.152 1.901 . . . . 0.0 111.856 177.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . 0.518 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 40.1 m-20 -72.73 -45.0 60.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.177 -177.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.612 ' HB2' HD13 ' A' 3501 ' ' LEU . 0.1 OUTLIER -83.09 -28.79 29.24 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 176.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.803 HD22 ' HA ' ' A' 3640 ' ' SER . 22.4 tp -50.54 -47.05 57.8 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.546 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.15 -19.01 61.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.945 0.402 . . . . 0.0 111.705 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 36.6 m -89.69 -31.05 17.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.839 0.352 . . . . 0.0 110.824 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.546 ' HA ' HG22 ' A' 3653 ' ' ILE . 6.5 pt -85.83 -13.77 10.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.623 -178.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 47.4 m -59.48 -22.17 61.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.795 0.331 . . . . 0.0 111.222 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -88.02 -38.37 15.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.481 0.658 . . . . 0.0 109.758 174.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.568 HD12 ' HG2' ' A' 3655 ' ' PRO . 8.2 tp -105.26 42.4 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 122.288 1.042 . . . . 0.0 109.408 -178.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.486 ' N ' ' HD2' ' A' 3655 ' ' PRO . 42.0 m -40.37 -42.0 2.86 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 114.384 -1.28 . . . . 0.0 113.148 171.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.568 ' HG2' HD12 ' A' 3653 ' ' ILE . 11.2 Cg_endo -58.15 83.45 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.635 1.557 . . . . 0.0 111.404 167.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.0 p-80 -149.26 169.71 20.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.253 -177.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.52 HD22 HG22 ' A' 3628 ' ' ILE . 46.3 mt -117.57 132.83 56.46 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.581 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . 0.63 ' HE3' ' HB2' ' A' 3629 ' ' PHE . 9.5 tmm? -99.61 109.82 22.3 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 177.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.83 HD12 HD21 ' A' 3524 ' ' LEU . 74.2 mt -107.31 121.48 60.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 121.281 0.562 . . . . 0.0 111.566 -170.152 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.746 HG13 ' HD2' ' A' 3573 ' ' TYR . 91.8 t -104.56 113.8 42.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.727 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.641 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 58.3 mt -91.02 115.53 30.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.829 177.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -124.47 132.51 53.49 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.834 -0.346 . . . . 0.0 111.622 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 24.7 m -86.03 112.44 21.24 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 171.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.533 -178.65 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.609 ' CD1' ' HB2' ' A' 3553 ' ' MET . 57.0 m-85 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.565 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.6 OUTLIER 56.13 -162.02 0.18 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.829 0.823 . . . . 0.0 111.848 176.69 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 25.7 m -146.32 117.88 8.02 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 114.613 -1.176 . . . . 0.0 108.032 168.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.545 HD13 ' HD2' ' A' 3552 ' ' ARG . 24.4 tp . . . . . 0 N--CA 1.449 -0.505 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.042 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.587 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp . . . . . 0 C--O 1.233 0.233 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.592 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.37 -15.56 63.75 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.546 -174.065 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.592 ' N ' HD13 ' A' 3502 ' ' LEU . 13.7 mptt -57.41 -42.64 82.69 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.212 173.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.477 ' HB3' ' CD2' ' A' 3505 ' ' TYR . 5.1 tmtm? -95.45 -38.6 10.39 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.737 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -147.06 101.39 3.87 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-O 121.302 0.572 . . . . 0.0 111.629 -177.422 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -86.23 174.02 6.38 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 124.158 3.239 . . . . 0.0 113.723 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.48 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 88.2 mt -71.88 131.34 34.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.243 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 29.3 m -100.96 -28.82 3.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.466 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.671 ' HE3' HD12 ' A' 3524 ' ' LEU . 14.0 t90 -153.11 155.05 36.05 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 110.229 -0.285 . . . . 0.0 110.229 -175.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -150.95 119.93 6.67 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.74 -130.52 1.23 Allowed Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 -178.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -136.87 152.71 50.54 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.359 0.6 . . . . 0.0 111.437 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.48 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 72.6 mt -105.53 153.61 21.51 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 168.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.666 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -146.64 124.07 11.67 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -177.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.785 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.3 144.61 38.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.687 172.674 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.785 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.7 OUTLIER 59.36 -93.56 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 122.964 0.506 . . . . 0.0 110.293 -170.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 20.2 m120 -141.78 7.31 1.86 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.842 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -104.51 129.67 52.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.115 0.484 . . . . 0.0 111.205 -177.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.613 HG22 ' HB2' ' A' 3514 ' ' ALA . 18.0 p -108.96 154.81 21.64 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.509 176.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -143.97 113.49 7.03 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.776 175.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.636 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.52 115.87 10.2 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.115 0.483 . . . . 0.0 110.059 177.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 28.0 m -129.67 147.77 33.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.582 0.706 . . . . 0.0 111.795 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . 0.428 ' HG2' ' HB3' ' A' 3581 ' ' CYS . 3.8 pt20 -108.59 125.73 52.16 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.021 -0.99 . . . . 0.0 108.861 172.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.879 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -93.07 111.37 22.98 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.421 0.629 . . . . 0.0 111.716 -175.957 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.48 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 70.2 m-70 -87.65 136.56 32.9 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.878 -1.055 . . . . 0.0 108.595 175.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.737 ' O ' ' HB2' ' A' 3505 ' ' TYR . 63.9 t80 -64.77 141.09 58.89 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.589 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.1 t -115.3 -58.36 3.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 CA-C-O 121.386 0.612 . . . . 0.0 110.64 174.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.502 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 58.3 m -160.74 171.66 18.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.197 -171.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.59 -149.0 20.29 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.516 -0.849 . . . . 0.0 112.609 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.563 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.0 t-20 -101.6 111.54 23.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.599 0.237 . . . . 0.0 110.494 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -61.15 -31.7 71.42 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.589 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 23.6 t -63.16 -32.3 55.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.508 -178.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.565 HD23 ' HD3' ' A' 3536 ' ' ARG . 28.8 mt -57.59 -39.44 76.81 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.086 177.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.473 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -67.38 -46.85 72.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.921 0.391 . . . . 0.0 110.297 179.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -63.58 -27.66 69.4 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.286 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.565 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.8 ptm180 -90.32 -14.92 32.18 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.452 ' O ' HG21 ' A' 3614 ' ' VAL . 21.7 p -103.78 -38.23 7.14 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.854 0.359 . . . . 0.0 111.949 -179.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.635 HD13 ' HB2' ' A' 3509 ' ' TRP . 19.4 mt -79.98 121.04 81.63 Favored Pre-proline 0 C--N 1.317 -0.815 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -175.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' 3538 ' ' LEU . 6.6 Cg_endo . . . . . 0 N--CA 1.456 -0.708 0 C-N-CA 122.592 2.194 . . . . 0.0 113.667 -173.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 16.4 Cg_exo . . . . . 0 N--CA 1.46 -0.446 0 CA-C-O 120.859 0.275 . . . . 0.0 112.018 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.666 ' HB3' HD13 ' A' 3612 ' ' ILE . 56.6 mt -74.09 112.25 10.04 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.932 177.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.666 ' HA ' ' O ' ' A' 3514 ' ' ALA . 16.2 ptt-85 -103.16 142.52 34.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.149 0.499 . . . . 0.0 111.003 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.483 HG22 HD12 ' B' 2521 ' ' LEU . 33.2 mt -95.86 108.76 21.58 Favored 'Isoleucine or valine' 0 C--O 1.245 0.855 0 CA-C-O 121.878 0.847 . . . . 0.0 112.016 -171.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.496 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.3 -1.28 15.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.966 -176.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.673 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 41.6 mt-30 -149.95 170.66 18.31 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.423 0.154 . . . . 0.0 111.038 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.719 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.14 141.21 17.34 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.934 0.397 . . . . 0.0 111.193 -179.68 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.601 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -110.6 121.39 45.2 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.402 178.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -63.34 110.68 1.99 Allowed 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.612 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -70.16 99.54 1.51 Allowed 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 122.152 0.977 . . . . 0.0 109.791 -178.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.597 ' O ' ' HG ' ' A' 3560 ' ' LEU . 38.5 mt-10 -112.91 160.08 18.42 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.634 -1.166 . . . . 0.0 109.659 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.607 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -52.53 -52.36 55.12 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.414 0.446 . . . . 0.0 111.202 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 7.0 p -58.85 -42.38 89.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.42 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.547 ' O ' HG23 ' A' 3563 ' ' VAL . 23.2 mm-40 -62.1 -48.07 81.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.035 177.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' 3556 ' ' GLU . 87.0 mt -61.05 -34.46 74.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.404 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' A' 3557 ' ' ALA . 29.6 mm-40 -59.38 -51.89 67.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.174 0.511 . . . . 0.0 109.878 175.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.31 -38.89 96.44 Favored Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.312 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' 3559 ' ' GLN . 83.9 t -61.24 -56.39 18.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.535 0.207 . . . . 0.0 110.644 178.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . 0.404 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -65.23 -29.03 69.79 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -175.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.416 ' NH1' ' HB3' ' A' 3561 ' ' GLU . 72.2 mtt180 -75.9 -22.83 55.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' 3563 ' ' VAL . 36.4 ptt180 -89.49 -12.32 40.4 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.669 169.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.536 ' HG3' ' O ' ' A' 3563 ' ' VAL . 78.1 mtp -81.72 -19.06 42.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.785 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 21.8 p -75.09 -19.23 60.06 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.408 0.623 . . . . 0.0 110.081 176.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.7 t -95.93 79.52 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.002 177.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.65 108.41 2.89 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.563 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 153.44 -43.24 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.52 1.528 . . . . 0.0 108.053 -175.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.25 -30.65 34.05 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.832 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.718 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -125.69 165.31 18.83 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.172 -179.891 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.625 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 25.4 t -127.09 135.79 51.25 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 171.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.762 HD22 HD13 ' A' 3642 ' ' LEU . 13.9 tp -106.16 125.17 50.66 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 178.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.61 HD11 HD11 ' A' 3661 ' ' ILE . 79.1 mt -127.19 151.78 48.24 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.149 0.499 . . . . 0.0 110.755 -177.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.698 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.03 108.68 14.59 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.512 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.39 122.4 36.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.304 0.573 . . . . 0.0 110.431 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.621 HD21 HG22 ' A' 3650 ' ' ILE . 82.5 mt -122.13 140.83 33.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.184 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.88 112.72 1.44 Allowed 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.393 2.062 . . . . 0.0 111.819 178.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . 0.428 ' HB3' ' HG2' ' A' 3523 ' ' GLN . 25.7 p -99.75 118.47 36.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.116 0.484 . . . . 0.0 110.293 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . 0.429 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.33 145.57 16.26 Favored Glycine 0 N--CA 1.442 -0.948 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.652 -178.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -76.87 -31.23 56.66 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.907 0.86 . . . . 0.0 109.353 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.562 ' H ' ' HB3' ' A' 3587 ' ' ASP . 22.8 t70 -134.47 167.66 20.36 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.346 -178.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -54.6 -43.55 72.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.005 0.431 . . . . 0.0 110.348 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.32 -33.68 71.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.176 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.562 ' HB3' ' H ' ' A' 3584 ' ' ASP . 6.8 t70 -64.93 -42.77 94.39 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' 3584 ' ' ASP . 93.8 t -56.28 -50.96 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.202 176.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 75.1 t -58.21 -50.51 78.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.695 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 42.1 t -55.43 -51.12 67.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.319 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -65.73 -36.98 85.13 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 121.22 -0.192 . . . . 0.0 111.225 -177.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . 0.446 ' O ' ' HB3' ' A' 3596 ' ' LYS . 49.2 m -64.41 -44.71 90.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.957 0.408 . . . . 0.0 110.181 176.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.453 ' HA ' ' CE ' ' A' 3596 ' ' LYS . 12.9 tp10 -61.01 -47.16 87.73 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.604 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 39.4 m -65.85 -47.72 73.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.047 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.554 HD12 ' HB2' ' A' 3599 ' ' PHE . 59.6 tp -59.5 -44.15 93.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.87 0.367 . . . . 0.0 110.73 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.695 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.9 OUTLIER -62.59 -35.76 80.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.262 -178.033 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . 0.417 ' O ' ' HB ' ' A' 3601 ' ' THR . . . -83.59 -41.18 18.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.728 0.299 . . . . 0.0 111.725 -178.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.494 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -86.57 -46.27 10.29 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -170.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.554 ' HB2' HD12 ' A' 3595 ' ' LEU . 19.6 m-85 -99.45 -50.5 4.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.711 0.291 . . . . 0.0 111.166 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.695 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.2 mm -60.88 -57.01 14.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.664 -176.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . 0.417 ' HB ' ' O ' ' A' 3597 ' ' ALA . 91.7 m -56.29 -49.11 75.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.022 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.663 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -59.52 -57.33 13.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.158 -179.489 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.663 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.3 OUTLIER -55.83 -42.28 75.49 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -178.52 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -75.85 -40.03 55.49 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.848 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -66.1 -46.43 77.64 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.988 0.423 . . . . 0.0 110.97 -178.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -77.74 -11.59 59.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.281 -178.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 50.36 63.22 2.29 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.255 -174.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.558 ' O ' HD12 ' A' 3603 ' ' LEU . . . -138.35 -176.28 4.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.213 0.53 . . . . 0.0 112.317 -173.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.719 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -122.89 117.78 26.37 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.33 174.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . 0.449 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.36 103.7 0.78 Allowed Glycine 0 C--O 1.222 -0.621 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.499 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.673 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 28.8 mm -89.42 124.33 42.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 121.212 0.53 . . . . 0.0 110.659 -175.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.666 HD13 ' HB3' ' A' 3547 ' ' LEU . 62.1 mt -124.2 105.99 16.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.108 177.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' 3624 ' ' TYR . 7.1 m120 -80.77 112.31 18.03 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.452 HG21 ' O ' ' A' 3537 ' ' SER . 6.2 p . . . . . 0 C--N 1.311 -1.068 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.815 -177.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.51 ' O ' ' HA ' ' A' 3613 ' ' ASN . 78.7 m-85 . . . . . 0 C--O 1.239 0.521 0 CA-C-O 120.691 0.282 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 20.1 t -116.1 114.98 47.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.935 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.599 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -99.45 115.44 29.28 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 168.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.501 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 97.9 mt-30 -94.66 111.32 23.09 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.04 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.594 HG12 HG12 ' A' 3659 ' ' ILE . 43.9 mt -90.46 98.46 8.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.961 178.096 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -88.48 145.04 34.66 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.085 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.558 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.3 Cg_endo -69.91 172.84 12.04 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.744 2.296 . . . . 0.0 111.901 177.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -70.88 46.69 0.66 Allowed 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 122.97 2.447 . . . . 0.0 112.272 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.5 p -80.66 162.63 24.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.276 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . 0.41 ' CD ' ' H ' ' A' 3633 ' ' GLU . 3.3 mp0 -53.73 -38.96 64.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.012 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 32.0 t80 -49.69 -50.04 45.26 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 121.284 0.564 . . . . 0.0 110.95 174.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 4.1 m -64.95 -52.9 53.77 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.153 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -52.19 -50.65 61.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.143 -176.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 51.3 p -60.56 -50.45 73.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.174 0.512 . . . . 0.0 110.711 -175.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 72.1 m80 -66.3 -36.24 82.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.975 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 76.4 mt -64.29 -34.67 78.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.052 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.989 ' HA ' HD22 ' A' 3647 ' ' LEU . 34.8 m -64.12 -37.1 86.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.224 0.535 . . . . 0.0 110.412 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.82 -51.11 9.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.202 178.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.762 HD13 HD22 ' A' 3575 ' ' LEU . 30.1 mt -72.45 -34.39 67.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.789 -171.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.422 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -151.35 84.39 5.22 Favored Pre-proline 0 C--N 1.328 -0.334 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -73.52 -23.12 17.56 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.6 2.2 . . . . 0.0 113.372 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 12.3 t0 -76.46 -52.91 8.91 Favored 'General case' 0 CA--C 1.515 -0.365 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 -175.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.698 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -69.79 -28.32 65.64 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 178.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.989 HD22 ' HA ' ' A' 3640 ' ' SER . 31.7 tp -51.12 -50.13 59.45 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.914 174.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.33 -23.75 65.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.179 -178.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 12.9 m -83.43 -36.38 24.26 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.436 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.621 HG22 HD21 ' A' 3579 ' ' LEU . 4.3 pt -81.31 -17.28 12.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.487 -177.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 49.6 m -58.44 -22.55 54.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.91 175.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . 0.424 HD22 ' N ' ' A' 3652 ' ' ASN . 0.9 OUTLIER -89.28 -37.09 15.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.016 0.436 . . . . 0.0 110.787 174.454 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.582 HG22 ' HA ' ' A' 3650 ' ' ILE . 7.5 tp -104.51 39.76 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 122.473 1.13 . . . . 0.0 109.307 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.464 ' N ' ' HD2' ' A' 3655 ' ' PRO . 20.2 m -35.53 -44.57 0.84 Allowed Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 113.784 -1.553 . . . . 0.0 114.038 173.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' 3654 ' ' SER . 20.2 Cg_endo -62.46 76.12 0.1 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.541 1.494 . . . . 0.0 112.008 171.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 34.6 p80 -145.65 175.47 10.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.121 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.478 HD22 HG22 ' A' 3628 ' ' ILE . 21.6 mt -120.6 152.32 38.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.77 -177.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 57.4 ttp -112.0 109.51 19.31 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.879 HD12 HD21 ' A' 3524 ' ' LEU . 81.1 mt -102.67 116.63 46.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 121.317 0.58 . . . . 0.0 111.325 -172.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.718 HG13 ' HD2' ' A' 3573 ' ' TYR . 82.1 t -102.47 115.28 44.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.023 -178.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.625 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 64.3 mt -90.9 121.85 41.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -123.68 126.54 46.75 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.722 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.5 m -104.93 110.47 22.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.832 169.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.03 -178.276 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.601 ' CD1' ' HB2' ' A' 3553 ' ' MET . 31.9 m-85 . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.516 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.5 OUTLIER 54.22 -162.97 0.12 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 122.022 0.915 . . . . 0.0 112.16 177.318 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 1.2 p -144.25 116.72 8.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.096 -1.411 . . . . 0.0 108.225 167.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.608 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.457 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.512 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.1 pp . . . . . 0 N--CA 1.453 -0.307 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.64 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.76 -17.32 64.5 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.436 -174.107 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.64 ' N ' HD13 ' A' 3502 ' ' LEU . 22.8 tptm -68.42 -28.15 66.82 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.065 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' 3504 ' ' LYS . 32.0 tptt -103.17 -42.29 5.81 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.257 0.551 . . . . 0.0 109.894 179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.742 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -146.26 97.16 4.45 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.553 -178.219 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -79.67 173.06 13.44 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.573 2.848 . . . . 0.0 113.524 -176.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.535 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.0 mt -73.0 137.2 23.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.132 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.44 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.5 m -105.11 -31.37 2.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.654 -178.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.773 ' HE3' HD12 ' A' 3524 ' ' LEU . 18.2 t90 -145.33 155.69 43.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.793 0.33 . . . . 0.0 110.825 -174.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -150.56 120.6 7.19 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 176.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -174.18 -132.32 1.53 Allowed Glycine 0 N--CA 1.444 -0.818 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -178.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.639 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.4 mp -138.1 155.69 48.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.058 0.456 . . . . 0.0 110.989 178.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.534 HD23 ' HB2' ' A' 3547 ' ' LEU . 91.2 mt -109.03 146.15 34.41 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 169.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.708 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.37 126.84 16.82 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.465 0.174 . . . . 0.0 110.918 -179.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.785 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.53 141.4 39.32 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 172.619 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.785 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 62.85 -86.99 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.196 0.598 . . . . 0.0 109.908 -171.532 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' 3517 ' ' ASN . 2.5 m120 -149.81 11.9 0.76 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.185 175.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.437 ' O ' ' HA ' ' A' 3514 ' ' ALA . 16.5 m-20 -103.0 139.4 38.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.358 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.522 HG22 ' HB2' ' A' 3514 ' ' ALA . 37.5 p -127.12 143.13 51.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.108 0.48 . . . . 0.0 111.71 -175.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -139.55 114.69 9.65 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.396 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.616 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -68.97 120.61 15.11 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 177.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.438 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 31.4 m -129.87 148.28 33.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 121.582 0.706 . . . . 0.0 112.181 -174.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -108.72 125.52 52.0 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 114.849 -1.068 . . . . 0.0 108.827 171.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.861 HD21 HD12 ' A' 3659 ' ' ILE . 2.1 mt -93.98 114.2 26.35 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.371 0.605 . . . . 0.0 111.637 -176.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.535 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 48.3 m80 -89.5 142.4 27.7 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.747 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.742 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.1 t80 -70.32 135.28 48.73 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 171.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.604 ' CG1' HD23 ' A' 3575 ' ' LEU . 24.3 t -114.33 -57.0 3.99 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-O 121.467 0.651 . . . . 0.0 110.283 176.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.574 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 66.1 m -160.0 171.21 19.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.111 -172.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 86.3 -152.57 25.61 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.432 -0.89 . . . . 0.0 111.744 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.554 ' HB2' ' HA ' ' A' 3571 ' ' THR . 3.4 t-20 -102.13 117.76 35.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.115 0.458 . . . . 0.0 110.758 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -65.24 -28.56 69.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.176 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . 0.4 ' HB ' ' OD1' ' A' 3530 ' ' ASN . 61.0 t -59.52 -33.13 50.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.477 178.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.57 HD23 ' HD3' ' A' 3536 ' ' ARG . 18.7 mt -58.94 -41.55 87.64 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.092 177.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.489 ' HB1' HD12 ' A' 3538 ' ' LEU . . . -69.23 -40.0 78.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.935 0.397 . . . . 0.0 110.361 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -65.45 -32.68 74.42 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.76 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.57 ' HD3' HD23 ' A' 3533 ' ' LEU . 11.2 ptm180 -90.13 -11.63 40.64 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . . . . . . . . . 26.7 p -104.12 -43.33 5.28 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.542 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.7 HD13 ' HB2' ' A' 3509 ' ' TRP . 35.8 mt -78.82 111.94 23.45 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-O 121.228 0.537 . . . . 0.0 110.033 -172.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . 0.513 ' HD3' HG21 ' A' 3614 ' ' VAL . 97.3 Cg_endo . . . . . 0 N--CA 1.453 -0.891 0 C-N-CA 123.101 2.534 . . . . 0.0 112.793 -172.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . 0.639 ' HA ' ' O ' ' A' 3512 ' ' LEU . 19.6 Cg_endo . . . . . 0 N--CA 1.453 -0.872 0 N-CA-C 113.455 0.521 . . . . 0.0 113.455 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.647 ' HB3' HD13 ' A' 3612 ' ' ILE . 26.7 mt -79.32 122.98 27.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.637 172.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.708 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -102.84 143.85 31.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 111.816 -174.571 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.517 HG22 HD12 ' B' 2521 ' ' LEU . 21.8 mt -98.93 107.45 20.52 Favored 'Isoleucine or valine' 0 C--O 1.248 0.978 0 CA-C-O 122.251 1.024 . . . . 0.0 111.903 -174.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.539 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -114.79 1.96 14.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.972 -174.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.678 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 66.8 mt-30 -148.99 172.47 14.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.476 0.179 . . . . 0.0 111.209 178.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.739 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.75 139.91 15.53 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.082 0.468 . . . . 0.0 111.621 -179.273 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.69 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 19.4 ttt -108.17 125.46 51.65 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.352 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -64.0 111.25 2.43 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 177.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.568 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -76.57 98.56 4.71 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 122.413 1.102 . . . . 0.0 109.476 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' 3560 ' ' LEU . 44.1 mt-10 -108.22 159.06 16.91 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.29 176.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -58.64 -41.69 86.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.473 0.654 . . . . 0.0 109.277 175.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' 3561 ' ' GLU . 0.7 OUTLIER -62.27 -41.23 98.28 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.827 177.882 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.54 ' O ' HG23 ' A' 3563 ' ' VAL . 17.2 mm-40 -70.28 -41.53 73.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.698 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' 3556 ' ' GLU . 85.4 mt -61.58 -35.31 77.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.501 178.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' 3558 ' ' THR . 45.2 mm-40 -55.28 -51.35 66.94 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.136 172.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.37 -44.39 98.11 Favored Glycine 0 CA--C 1.519 0.29 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.432 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' 3559 ' ' GLN . 57.3 t -59.54 -52.43 61.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.503 0.192 . . . . 0.0 110.616 179.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . 0.546 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.96 -32.25 71.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.026 0.441 . . . . 0.0 111.046 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.478 ' O ' HG22 ' A' 3568 ' ' THR . 41.8 ttp180 -63.06 -38.27 90.52 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.167 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . 0.463 HH22 ' HH ' ' B' 2518 ' ' TYR . 25.2 ptt180 -88.5 -10.86 47.54 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.899 -0.32 . . . . 0.0 111.282 175.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.546 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 65.0 mtp -80.14 -26.55 39.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.975 177.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . 0.478 HG22 ' O ' ' A' 3565 ' ' ARG . 8.5 t -74.73 -9.43 58.55 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.983 0.42 . . . . 0.0 110.834 -177.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 40.8 t -111.26 87.63 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.302 0.572 . . . . 0.0 110.236 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.15 110.42 4.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.178 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.554 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.6 m 150.94 -40.62 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.747 1.619 . . . . 0.0 107.825 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -80.69 -30.83 36.41 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.629 -179.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.667 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -126.72 166.5 17.28 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.058 178.626 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.622 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 33.7 t -129.27 135.81 49.26 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 171.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.778 HD22 HD13 ' A' 3642 ' ' LEU . 9.4 tp -105.87 124.8 50.15 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 177.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.58 HD11 HD11 ' A' 3661 ' ' ILE . 80.9 mt -125.1 158.1 34.67 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.038 0.447 . . . . 0.0 110.888 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.753 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -125.74 106.9 10.04 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.391 -179.365 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.51 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.61 123.64 38.17 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.324 0.583 . . . . 0.0 110.605 -177.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.473 HD23 ' HB2' ' A' 3656 ' ' HIS . 39.5 mt -126.42 145.05 51.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 114.706 -1.133 . . . . 0.0 109.912 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . 0.435 ' HA ' ' O ' ' A' 3521 ' ' ALA . 17.8 Cg_endo -60.23 111.38 0.99 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 122.323 2.016 . . . . 0.0 112.079 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.1 p -96.5 113.22 24.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.16 0.505 . . . . 0.0 109.975 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . 0.453 ' HA3' HG22 ' A' 3588 ' ' VAL . . . -96.36 146.15 18.13 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.111 -175.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -73.31 -15.48 61.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.935 0.874 . . . . 0.0 109.417 177.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.643 ' O ' HG23 ' A' 3588 ' ' VAL . 16.7 t70 -158.35 167.03 30.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.113 -1.403 . . . . 0.0 107.22 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -58.62 -40.9 84.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 118.144 0.429 . . . . 0.0 110.47 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.51 -37.23 86.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.513 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.533 ' HB3' ' H ' ' A' 3584 ' ' ASP . 17.1 t70 -63.45 -44.26 95.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.769 178.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' 3584 ' ' ASP . 58.1 t -54.1 -42.52 55.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.727 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 5.4 t -62.75 -49.27 84.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.629 0.728 . . . . 0.0 109.571 -178.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 55.8 m -62.74 -39.9 95.53 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.765 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . 0.484 HE21 ' HB3' ' A' 3521 ' ' ALA . 13.7 mm100 -70.56 -39.48 73.92 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.358 -0.214 . . . . 0.0 110.972 179.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 73.8 m -60.14 -50.32 74.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.842 0.353 . . . . 0.0 111.157 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.537 ' HA ' ' HG2' ' A' 3596 ' ' LYS . 11.4 pt-20 -66.76 -30.89 71.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.166 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 50.5 m -70.54 -40.47 73.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.089 0.471 . . . . 0.0 110.219 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.522 HD12 ' HB2' ' A' 3599 ' ' PHE . 59.5 tp -65.61 -46.16 80.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.09 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.793 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 19.9 ptmt -65.65 -34.39 78.11 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.256 -178.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -78.17 -39.19 41.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.671 0.272 . . . . 0.0 111.393 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.49 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -91.05 -46.26 8.23 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -172.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.522 ' HB2' HD12 ' A' 3595 ' ' LEU . 19.1 m-85 -99.01 -50.37 4.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.774 0.321 . . . . 0.0 111.533 -174.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.793 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 23.2 mm -61.91 -58.13 8.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.067 -175.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 87.7 m -57.55 -42.54 83.19 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.147 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.797 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -62.43 -57.37 11.5 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 121.366 -0.133 . . . . 0.0 110.979 178.325 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.797 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.1 OUTLIER -57.13 -39.2 74.69 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.58 0.229 . . . . 0.0 111.466 -176.322 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -77.53 -38.13 49.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.748 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.74 -35.56 75.08 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.966 0.413 . . . . 0.0 111.129 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' 3602 ' ' TYR . 27.1 mmmt -87.71 -9.09 55.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.931 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 47.33 63.45 1.97 Allowed 'General case' 0 C--O 1.235 0.328 0 O-C-N 123.764 0.665 . . . . 0.0 111.266 -177.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.561 ' O ' HD12 ' A' 3603 ' ' LEU . . . -143.23 -177.42 5.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.009 -0.541 . . . . 0.0 112.027 -175.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.739 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -116.04 118.25 32.37 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.164 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . 0.445 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.07 102.73 0.55 Allowed Glycine 0 C--O 1.223 -0.547 0 C-N-CA 120.718 -0.753 . . . . 0.0 111.343 178.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.678 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.6 mm -89.55 123.84 41.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.238 0.542 . . . . 0.0 110.795 -175.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.647 HD13 ' HB3' ' A' 3547 ' ' LEU . 53.8 mt -119.23 106.79 19.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.739 175.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.45 ' HA ' ' O ' ' A' 3624 ' ' TYR . 4.1 m120 -82.97 106.85 15.14 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 175.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.513 HG21 ' HD3' ' A' 3539 ' ' PRO . 9.3 p . . . . . 0 C--N 1.312 -1.058 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.143 -171.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.45 ' O ' ' HA ' ' A' 3613 ' ' ASN . 79.0 m-85 . . . . . 0 C--O 1.236 0.363 0 CA-C-O 121.061 0.458 . . . . 0.0 110.52 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.455 HG13 HD12 ' A' 3611 ' ' ILE . 15.5 t -113.39 114.28 46.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.972 176.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.626 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.4 mp -100.41 113.44 26.2 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.483 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 14.3 mt-30 -94.68 110.38 22.22 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.647 -178.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.589 HG12 HG12 ' A' 3659 ' ' ILE . 40.5 mt -91.82 98.19 8.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.072 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -88.58 141.71 30.49 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.297 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.649 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 57.2 Cg_endo -71.31 164.6 35.2 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.572 2.182 . . . . 0.0 111.504 176.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.26 85.86 0.33 Allowed 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.799 2.333 . . . . 0.0 112.016 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . 0.55 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.1 p -112.4 162.12 15.92 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.002 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -55.74 -33.78 64.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.684 0.278 . . . . 0.0 110.305 179.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.97 -42.58 80.65 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.084 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . 0.464 ' O ' ' HG ' ' A' 3639 ' ' LEU . 58.7 p -65.32 -52.55 53.22 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.105 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' A' 3632 ' ' CYS . 5.6 mm-40 -63.68 -35.53 80.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.402 -175.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 14.3 p -64.56 -54.69 28.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.606 -176.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -71.34 -19.47 62.29 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 118.871 -1.132 . . . . 0.0 110.733 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' 3635 ' ' SER . 41.9 mt -64.9 -35.84 82.44 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.23 172.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.534 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 18.1 m -70.31 -31.83 69.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.423 0.63 . . . . 0.0 109.941 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -76.06 -43.92 41.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.849 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.778 HD13 HD22 ' A' 3575 ' ' LEU . 17.9 mt -85.21 -38.96 18.34 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.512 -0.767 . . . . 0.0 112.753 -172.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -147.85 82.92 7.66 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.899 0.381 . . . . 0.0 111.556 -177.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.59 -28.06 21.74 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.069 2.513 . . . . 0.0 113.882 -174.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 4.2 t0 -77.73 -37.93 48.19 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.33 -172.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.753 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -80.03 -31.17 39.57 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 175.184 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.534 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.04 -43.69 70.39 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.452 177.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -62.05 -25.76 67.87 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.382 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 73.3 m -78.92 -40.23 32.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.026 0.441 . . . . 0.0 110.598 176.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.861 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.8 pt -82.79 -18.32 10.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.818 -172.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.9 t -59.08 -25.69 63.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -88.84 -35.0 16.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.919 0.39 . . . . 0.0 110.617 174.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.861 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.4 OUTLIER -98.84 30.97 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 122.81 1.291 . . . . 0.0 109.083 -175.56 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.427 ' N ' ' HD2' ' A' 3655 ' ' PRO . 18.7 m -30.03 -42.88 0.2 Allowed Pre-proline 0 CA--C 1.542 0.657 0 CA-C-N 113.763 -1.562 . . . . 0.0 114.851 173.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.431 ' HG2' HD13 ' A' 3653 ' ' ILE . 15.9 Cg_endo -60.55 65.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.849 1.699 . . . . 0.0 112.345 168.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . 0.473 ' HB2' HD23 ' A' 3579 ' ' LEU . 23.6 p80 -136.37 174.15 10.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.866 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.525 HD22 HG22 ' A' 3628 ' ' ILE . 31.6 mt -119.93 149.12 42.63 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.765 0.317 . . . . 0.0 110.853 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 51.8 ttp -112.88 110.94 21.35 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.861 HD12 HD21 ' A' 3524 ' ' LEU . 71.0 mt -105.63 118.35 52.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.153 0.501 . . . . 0.0 111.42 -172.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.667 HG13 ' HD2' ' A' 3573 ' ' TYR . 77.2 t -103.18 116.76 47.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.805 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.626 HG12 ' HG ' ' A' 3626 ' ' LEU . 59.1 mt -90.95 114.98 29.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.11 127.94 56.35 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.852 0.358 . . . . 0.0 111.443 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 8.5 m -70.1 137.94 51.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.831 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.518 179.154 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.491 ' CD1' ' HB2' ' A' 3553 ' ' MET . 38.1 m-85 . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' A' 3551 ' ' GLN . 1.3 tp10 55.29 -160.81 0.17 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.139 0.495 . . . . 0.0 110.897 175.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 7.7 p -144.2 129.9 19.19 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 167.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.575 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.326 -0.454 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.526 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp . . . . . 0 N--CA 1.458 -0.073 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.709 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -73.12 -15.53 61.48 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.098 -0.641 . . . . 0.0 110.477 -174.202 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.59 ' N ' HD13 ' A' 3502 ' ' LEU . 55.5 tptt -68.13 -28.33 67.22 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 175.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.452 ' HB3' ' CE2' ' A' 3505 ' ' TYR . 4.3 mmmm -92.26 -42.96 9.55 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.776 175.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.729 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -153.5 108.6 2.57 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.812 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . 0.709 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 94.0 Cg_endo -87.49 173.55 5.38 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 124.127 3.218 . . . . 0.0 114.025 -175.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.429 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.3 mt -72.11 132.71 33.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.61 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.462 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.0 m -103.4 -31.15 2.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.596 -177.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.722 ' HE3' HD12 ' A' 3524 ' ' LEU . 47.3 t90 -147.56 153.64 39.7 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -175.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . 0.476 ' HG3' ' HB3' ' A' 3523 ' ' GLN . 21.7 tt0 -151.25 120.01 6.57 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -176.13 -123.29 0.76 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.676 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.5 mp -141.04 157.12 45.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.059 0.457 . . . . 0.0 111.059 179.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.444 ' HG ' HG21 ' A' 3522 ' ' VAL . 92.3 mt -108.91 151.29 26.48 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 168.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.739 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -147.65 126.92 13.02 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.74 0.305 . . . . 0.0 111.465 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.748 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.28 141.84 41.95 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 172.914 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.748 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.6 OUTLIER 63.6 -92.12 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -169.446 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 11.5 m120 -147.22 15.1 1.15 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 172.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.487 ' O ' ' HA ' ' A' 3514 ' ' ALA . 4.9 m-20 -96.02 123.26 39.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.361 -176.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.494 HG22 ' HB2' ' A' 3514 ' ' ALA . 37.0 p -113.75 138.77 49.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.074 0.464 . . . . 0.0 111.63 -177.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.97 116.11 14.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.473 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.644 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.73 122.94 20.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.97 0.414 . . . . 0.0 110.333 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.444 HG21 ' HG ' ' A' 3513 ' ' LEU . 35.2 m -132.43 149.03 31.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.915 -175.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . 0.476 ' HB3' ' HG3' ' A' 3510 ' ' GLN . 11.2 pt20 -112.45 127.59 56.08 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 170.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.887 HD21 HD12 ' A' 3659 ' ' ILE . 1.2 mt -95.35 113.3 24.95 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.039 -174.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.429 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 80.2 m-70 -88.0 136.31 33.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.714 175.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.729 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.1 t80 -67.67 139.55 56.78 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 174.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.572 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.5 t -115.1 -58.11 3.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 121.387 0.613 . . . . 0.0 110.979 176.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.44 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 65.0 m -159.69 171.91 18.7 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.275 -171.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.36 -152.02 23.11 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.632 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.59 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.6 t-20 -100.24 112.89 25.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.843 0.354 . . . . 0.0 110.608 -178.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -64.67 -32.08 73.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.495 -176.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 39.9 t -59.47 -32.37 48.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.42 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.46 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 20.3 mt -58.42 -45.81 87.69 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.775 176.12 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -66.6 -40.84 89.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.112 0.482 . . . . 0.0 110.076 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 14.7 t60 -57.57 -41.73 81.68 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.707 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -89.19 -14.32 36.32 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -176.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.451 ' O ' HG21 ' A' 3614 ' ' VAL . 42.4 p -96.81 -39.25 9.52 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 121.981 -0.449 . . . . 0.0 111.617 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.722 HD13 ' HB2' ' A' 3509 ' ' TRP . 31.1 mt -80.43 108.65 10.21 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-O 120.926 0.393 . . . . 0.0 109.978 -175.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo . . . . . 0 N--CA 1.459 -0.547 0 C-N-CA 122.854 2.369 . . . . 0.0 113.06 -171.902 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . 0.676 ' HA ' ' O ' ' A' 3512 ' ' LEU . 34.8 Cg_endo . . . . . 0 CA--C 1.529 0.266 0 N-CA-C 113.439 0.515 . . . . 0.0 113.439 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.688 ' HB3' HD13 ' A' 3612 ' ' ILE . 29.1 mt -69.24 124.18 23.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.84 173.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.739 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -105.05 142.49 34.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.782 0.325 . . . . 0.0 111.773 -173.903 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.557 HG22 HD12 ' B' 2521 ' ' LEU . 34.9 mt -98.89 107.03 19.76 Favored 'Isoleucine or valine' 0 C--O 1.254 1.298 0 CA-C-O 122.608 1.194 . . . . 0.0 112.069 -172.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -107.34 -9.04 16.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.614 -1.175 . . . . 0.0 111.949 -173.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.657 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 58.8 mt-30 -146.29 175.2 10.7 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.951 -0.113 . . . . 0.0 110.859 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.686 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.32 137.0 13.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.87 0.367 . . . . 0.0 111.353 -179.558 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.64 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 13.6 tmm? -108.17 113.79 27.19 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.174 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' 3556 ' ' GLU . 14.1 mmt180 -62.52 110.34 1.66 Allowed 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 175.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.494 ' O ' HD12 ' A' 3555 ' ' LEU . 2.3 pp -68.29 97.96 0.78 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.304 1.05 . . . . 0.0 109.809 -173.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.622 ' O ' ' HG ' ' A' 3560 ' ' LEU . 41.5 mt-10 -95.34 154.41 17.21 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.256 -1.338 . . . . 0.0 109.482 -178.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.612 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.49 -42.68 74.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.22 0.534 . . . . 0.0 109.725 174.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 19.3 m -63.26 -41.5 99.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.945 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.585 ' O ' HG23 ' A' 3563 ' ' VAL . 27.7 mm-40 -62.97 -48.34 79.29 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.435 177.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' 3556 ' ' GLU . 69.5 mt -59.02 -35.87 74.0 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.288 0.367 . . . . 0.0 110.873 -178.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.9 mm-40 -57.97 -51.72 68.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.428 0.632 . . . . 0.0 110.497 174.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -63.95 -40.1 97.95 Favored Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.226 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.664 ' O ' ' HG3' ' A' 3567 ' ' MET . 73.2 t -59.62 -48.18 88.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 176.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -53.67 -42.7 68.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.196 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.569 ' O ' ' HB ' ' A' 3568 ' ' THR . 96.4 mtt180 -60.42 -44.46 95.74 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.851 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -76.55 -15.3 59.9 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.087 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.664 ' HG3' ' O ' ' A' 3563 ' ' VAL . 88.0 mtp -83.74 -19.19 35.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.687 0.756 . . . . 0.0 109.126 173.016 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . 0.569 ' HB ' ' O ' ' A' 3565 ' ' ARG . 56.2 m -77.06 -21.59 54.23 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.009 176.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 60.5 t -116.45 84.51 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.9 177.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.0 108.13 3.4 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.59 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 1.9 m 157.88 -42.99 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.249 1.42 . . . . 0.0 108.02 -173.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -84.8 -17.36 38.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.025 -177.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.724 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -138.17 163.9 30.54 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 120.979 0.419 . . . . 0.0 109.994 177.401 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.631 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 29.3 t -126.12 135.64 51.94 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 172.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.746 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.97 125.54 51.11 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.603 HD11 HD11 ' A' 3661 ' ' ILE . 82.2 mt -126.72 154.89 43.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.11 0.481 . . . . 0.0 110.837 -177.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.608 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.83 108.02 13.43 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.611 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.488 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.68 122.42 37.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.299 0.571 . . . . 0.0 110.495 -177.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.457 ' HG ' HD12 ' A' 3577 ' ' LEU . 83.4 mt -126.75 142.01 42.08 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.688 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . 0.495 ' HA ' ' O ' ' A' 3521 ' ' ALA . 20.5 Cg_endo -60.46 117.3 4.05 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 122.67 2.247 . . . . 0.0 112.091 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.4 p -101.58 107.8 19.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.272 0.558 . . . . 0.0 111.003 -177.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.71 146.18 16.34 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.604 -179.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 5.2 ttp85 -64.72 -35.29 80.57 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.596 0.712 . . . . 0.0 110.064 176.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.598 ' O ' HG23 ' A' 3588 ' ' VAL . 15.1 t70 -134.92 164.37 27.75 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -55.42 -38.38 68.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 117.994 0.361 . . . . 0.0 110.392 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -62.2 -44.64 96.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.507 176.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.456 ' HB3' ' H ' ' A' 3584 ' ' ASP . 24.4 t0 -63.71 -40.87 97.84 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.013 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' 3584 ' ' ASP . 91.4 t -57.04 -48.55 81.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.043 176.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 65.5 t -57.36 -48.73 82.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.348 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 48.0 t -54.86 -53.34 56.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.097 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -66.25 -36.11 82.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.387 -177.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 78.7 m -60.73 -50.94 71.47 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 176.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.524 ' HA ' ' HD3' ' A' 3596 ' ' LYS . 39.5 tp10 -61.3 -44.45 97.19 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.005 -178.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 37.5 m -61.36 -45.34 94.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.69 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.559 HD12 ' HB2' ' A' 3599 ' ' PHE . 59.5 tp -60.85 -42.77 98.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.429 178.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.568 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 50.2 mtpt -55.78 -54.16 47.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.853 177.316 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.79 -40.67 88.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.274 -176.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -89.93 -46.86 8.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -169.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.559 ' HB2' HD12 ' A' 3595 ' ' LEU . 22.3 m-85 -99.56 -50.43 4.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.753 0.311 . . . . 0.0 111.515 -175.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.568 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.0 mm -61.32 -54.39 35.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.717 -176.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 45.8 m -59.89 -41.12 90.89 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.267 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.702 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -65.98 -57.03 8.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.906 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.702 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.3 OUTLIER -56.8 -43.61 81.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -177.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -69.63 -35.83 75.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.491 -176.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -67.86 -38.89 83.68 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.105 0.478 . . . . 0.0 110.659 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -78.81 -18.04 54.73 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.627 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 49.67 53.7 12.28 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -169.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.521 ' O ' HD12 ' A' 3603 ' ' LEU . . . -133.94 -175.89 3.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.044 -170.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.686 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.38 118.32 30.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.411 175.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . 0.493 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.77 104.03 0.79 Allowed Glycine 0 C--O 1.221 -0.707 0 C-N-CA 120.718 -0.753 . . . . 0.0 111.292 177.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.657 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 38.9 mm -90.12 122.45 41.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 121.333 0.587 . . . . 0.0 111.439 -173.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.688 HD13 ' HB3' ' A' 3547 ' ' LEU . 51.1 mt -119.71 111.56 33.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.221 176.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' A' 3624 ' ' TYR . 0.8 OUTLIER -87.46 125.59 34.39 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.451 HG21 ' O ' ' A' 3537 ' ' SER . 5.3 p . . . . . 0 C--N 1.315 -0.919 0 CA-C-O 121.02 0.438 . . . . 0.0 111.262 -178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.517 ' O ' ' HA ' ' A' 3613 ' ' ASN . 86.4 m-85 . . . . . 0 CA--C 1.506 -0.74 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.477 HG12 ' HG3' ' A' 3627 ' ' GLN . 4.1 t -122.23 113.16 37.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.902 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.66 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -94.46 111.34 23.09 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 170.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.487 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 63.0 mt-30 -94.4 110.66 22.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.76 -177.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.607 HG12 HG12 ' A' 3659 ' ' ILE . 32.8 mt -90.87 97.84 7.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.086 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -86.29 141.2 34.63 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.984 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.655 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 60.7 Cg_endo -72.92 169.69 21.52 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.486 2.124 . . . . 0.0 111.361 176.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.03 77.63 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.441 2.094 . . . . 0.0 111.64 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . 0.537 ' O ' ' HG2' ' A' 3636 ' ' GLU . 10.4 p -112.88 162.64 15.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.044 -174.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -45.99 -39.75 9.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.469 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 46.6 t80 -61.52 -52.98 62.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.495 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 56.4 p -66.37 -54.77 20.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.927 -175.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' 3632 ' ' CYS . 5.3 mm-40 -59.39 -38.56 80.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.268 -173.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 39.0 t -66.33 -50.11 64.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.752 0.311 . . . . 0.0 110.667 -178.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -65.81 -31.81 72.99 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.42 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.92 -30.98 72.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.956 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.763 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 20.1 m -74.84 -31.46 61.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.323 0.582 . . . . 0.0 109.89 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -79.61 -47.2 15.86 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.932 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.746 HD13 HD22 ' A' 3575 ' ' LEU . 14.7 mt -79.36 -41.8 27.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.139 -173.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -138.2 72.08 46.28 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -174.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -64.71 -19.29 64.47 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.207 1.938 . . . . 0.0 112.014 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . 0.473 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 6.6 m-20 -67.84 -60.78 2.25 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.559 -178.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.608 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -77.15 -26.42 53.03 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.635 -178.27 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.763 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.18 -44.12 71.27 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.231 177.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.99 -18.07 63.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.47 -178.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 17.9 m -89.62 -36.76 15.1 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.052 0.453 . . . . 0.0 110.545 177.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.777 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.2 pt -83.11 -10.5 11.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.785 -174.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.4 p -60.06 -25.18 65.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.958 0.408 . . . . 0.0 110.402 176.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -83.93 -41.87 16.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.313 0.577 . . . . 0.0 110.011 173.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.777 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.3 OUTLIER -99.57 34.21 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-O 123.184 1.469 . . . . 0.0 109.094 -172.366 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.45 ' N ' ' HD2' ' A' 3655 ' ' PRO . 23.2 m -34.67 -43.99 0.59 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 113.529 -1.669 . . . . 0.0 114.489 173.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' 3654 ' ' SER . 15.8 Cg_endo -60.19 86.05 0.07 OUTLIER 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.656 1.571 . . . . 0.0 111.821 170.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 3.8 p-80 -152.12 178.29 9.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.488 -176.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.501 ' HB3' HG23 ' A' 3628 ' ' ILE . 42.2 mt -126.9 133.62 50.63 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.474 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 60.1 ttp -97.32 109.99 22.63 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.887 HD12 HD21 ' A' 3524 ' ' LEU . 92.3 mt -100.59 116.74 44.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.28 0.562 . . . . 0.0 111.459 -173.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.724 HG13 ' HD2' ' A' 3573 ' ' TYR . 93.2 t -102.84 113.0 38.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.97 -178.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.66 HG12 ' HG ' ' A' 3626 ' ' LEU . 53.6 mt -90.78 113.13 26.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.294 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.62 127.98 55.91 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.687 0.279 . . . . 0.0 111.07 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 11.7 p -95.85 110.94 23.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.056 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 6.9 m . . . . . 0 C--O 1.248 0.98 0 CA-C-O 119.409 -0.329 . . . . 0.0 111.074 -178.808 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.571 ' CD1' ' HB2' ' A' 3553 ' ' MET . 20.3 m-85 . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.577 ' CG ' ' H ' ' B' 2520 ' ' THR . 8.6 tt0 55.98 -158.24 0.23 Allowed 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 175.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.577 ' H ' ' CG ' ' B' 2519 ' ' GLU . 88.9 m -151.78 123.65 8.03 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 174.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.624 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.517 -0.315 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -178.328 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.613 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.7 pp . . . . . 0 N--CA 1.455 -0.194 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.64 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -71.31 -15.76 62.42 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.192 -173.31 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.64 ' N ' HD13 ' A' 3502 ' ' LEU . 23.5 tptm -69.59 -27.06 64.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.273 177.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.713 ' HD3' ' CE2' ' A' 3505 ' ' TYR . 32.5 tttt -100.37 -42.02 6.8 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.475 179.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.713 ' CE2' ' HD3' ' A' 3504 ' ' LYS . 0.1 OUTLIER -146.71 106.9 4.02 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.308 177.038 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -86.52 174.01 6.09 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 124.27 3.313 . . . . 0.0 113.886 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.559 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 95.2 mt -72.05 138.79 20.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.118 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.439 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.7 m -105.94 -28.17 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.785 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.649 ' HB2' HD13 ' A' 3538 ' ' LEU . 21.1 t90 -153.54 154.75 34.89 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -176.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -151.14 121.4 7.27 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.117 0.484 . . . . 0.0 110.126 178.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -171.75 -123.94 0.73 Allowed Glycine 0 N--CA 1.441 -0.997 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.662 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.1 mp -141.34 158.76 43.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.1 0.476 . . . . 0.0 111.094 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.452 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.5 mt -112.79 151.46 30.32 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 168.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.668 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.75 125.93 14.66 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.729 0.3 . . . . 0.0 111.575 -178.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.788 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.02 142.59 38.25 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 173.119 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.788 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 59.88 -94.93 0.05 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.119 0.485 . . . . 0.0 110.157 -171.268 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -136.47 4.78 2.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.192 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.429 ' O ' ' HA ' ' A' 3514 ' ' ALA . 47.8 m-20 -102.53 138.54 39.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.333 -172.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.537 HG22 ' HB2' ' A' 3514 ' ' ALA . 27.8 p -127.02 138.04 53.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.943 -179.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -133.83 119.97 19.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.08 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.662 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -71.92 120.19 17.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.049 0.452 . . . . 0.0 110.52 178.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.433 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 33.7 m -132.06 147.76 32.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.857 -175.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -110.95 129.9 55.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.838 172.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.886 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -98.09 110.67 23.21 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.356 0.598 . . . . 0.0 111.886 -175.51 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.559 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 54.8 m-70 -84.99 137.11 33.28 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.56 175.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.707 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.7 t80 -67.08 136.38 55.1 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 173.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.563 ' CG1' HD23 ' A' 3575 ' ' LEU . 18.8 t -115.11 -55.89 4.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.42 0.629 . . . . 0.0 110.798 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.415 ' OG ' HD22 ' A' 3642 ' ' LEU . 48.0 t -159.04 171.72 19.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.708 -172.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.42 -150.22 21.14 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.766 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.7 t-20 -104.87 110.33 22.65 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -61.64 -29.6 70.17 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.544 -176.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . 0.538 ' HB ' ' OD1' ' A' 3530 ' ' ASN . 60.9 t -60.55 -33.46 54.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.364 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.552 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 20.4 mt -57.37 -41.46 80.21 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.944 176.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.519 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.76 -45.62 77.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.847 0.356 . . . . 0.0 110.462 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -60.99 -33.88 73.93 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.187 -178.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.403 ' HD3' HD23 ' A' 3533 ' ' LEU . 15.5 ptm180 -90.01 -13.91 35.04 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -178.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.458 ' HB2' HD11 ' A' 3626 ' ' LEU . 66.5 p -101.87 -34.72 9.28 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 122.014 -0.429 . . . . 0.0 111.317 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.649 HD13 ' HB2' ' A' 3509 ' ' TRP . 26.9 mt -80.44 114.08 44.57 Favored Pre-proline 0 C--N 1.319 -0.72 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -177.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo . . . . . 0 N--CA 1.455 -0.736 0 C-N-CA 123.073 2.515 . . . . 0.0 113.431 -169.975 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . 0.603 ' HA ' ' O ' ' A' 3512 ' ' LEU . 37.1 Cg_endo . . . . . 0 N--CA 1.461 -0.397 0 N-CA-C 112.801 0.27 . . . . 0.0 112.801 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.729 ' HB3' HD13 ' A' 3612 ' ' ILE . 37.9 mt -68.82 118.09 11.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.4 178.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.668 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.1 OUTLIER -94.24 133.75 37.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.199 0.523 . . . . 0.0 111.439 -178.116 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.63 HG22 HD12 ' B' 2521 ' ' LEU . 23.1 mt -84.49 108.05 16.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-O 122.185 0.993 . . . . 0.0 110.75 -177.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -105.01 -12.31 16.23 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.594 -1.184 . . . . 0.0 111.733 -171.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.652 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 87.5 mt-30 -150.36 177.55 9.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.54 -177.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.724 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.32 141.7 19.64 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 120.693 0.282 . . . . 0.0 111.411 179.495 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.629 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.5 tmm? -109.75 109.03 19.6 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 175.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . 0.445 ' O ' ' HG3' ' A' 3556 ' ' GLU . 49.1 mtt180 -58.97 110.97 1.14 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' 3555 ' ' LEU . 2.3 pp -68.39 99.18 0.91 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 122.304 1.049 . . . . 0.0 110.56 -173.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.523 ' O ' ' HG ' ' A' 3560 ' ' LEU . 33.9 mt-10 -103.04 157.76 16.77 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.081 176.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.508 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.91 -50.53 70.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.622 0.249 . . . . 0.0 110.908 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 25.6 p -62.19 -39.66 93.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.988 0.423 . . . . 0.0 111.255 178.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.519 ' O ' HG23 ' A' 3563 ' ' VAL . 57.5 mm-40 -65.97 -41.13 91.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.563 -178.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.54 HD21 ' HB2' ' A' 3555 ' ' LEU . 83.7 mt -64.24 -34.78 78.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.779 0.323 . . . . 0.0 110.809 -179.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' 3557 ' ' ALA . 12.1 mm-40 -68.66 -41.66 79.0 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 174.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -57.8 -41.51 94.04 Favored Glycine 0 CA--C 1.517 0.164 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.796 175.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.561 ' O ' ' HG3' ' A' 3567 ' ' MET . 95.5 t -61.7 -51.38 73.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 174.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . 0.515 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.63 -24.05 63.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.903 -178.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -61.15 -40.02 92.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.88 0.371 . . . . 0.0 110.536 -179.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' 3566 ' ' ARG . 9.9 ptp180 -87.99 -14.69 38.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.998 0.427 . . . . 0.0 110.569 176.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.561 ' HG3' ' O ' ' A' 3563 ' ' VAL . 84.9 mtp -74.68 -19.9 60.08 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.188 -178.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 14.7 t -89.01 3.29 52.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.112 0.482 . . . . 0.0 110.078 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 28.1 t -125.99 91.27 1.75 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.52 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -67.56 110.23 3.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.349 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.557 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 144.19 -38.98 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.561 1.544 . . . . 0.0 108.583 -177.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -82.19 -20.65 37.39 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.782 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.747 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -144.38 165.55 27.59 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.195 176.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.608 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 37.2 t -127.8 135.99 50.85 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 170.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.792 HD22 HD13 ' A' 3642 ' ' LEU . 14.7 tp -106.46 125.45 51.01 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.59 HD11 HD11 ' A' 3661 ' ' ILE . 78.7 mt -126.57 153.44 45.23 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.203 0.525 . . . . 0.0 110.558 -178.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.621 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.0 108.12 13.92 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.974 -0.751 . . . . 0.0 108.974 -179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.485 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 121.18 35.67 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.363 0.601 . . . . 0.0 110.449 -177.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.43 ' HG ' HD12 ' A' 3577 ' ' LEU . 68.2 mt -121.04 144.11 38.55 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 114.744 -1.117 . . . . 0.0 110.142 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.09 109.9 0.91 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.215 1.944 . . . . 0.0 111.705 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 18.2 p -95.96 115.72 27.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.208 0.528 . . . . 0.0 110.2 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . 0.442 ' HA3' HG22 ' A' 3588 ' ' VAL . . . -102.38 145.87 16.66 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.432 -0.889 . . . . 0.0 112.963 -176.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -19.35 63.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.827 0.822 . . . . 0.0 109.689 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.66 ' O ' HG23 ' A' 3588 ' ' VAL . 31.7 t70 -156.97 164.41 38.05 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -57.17 -35.57 69.71 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.021 0.439 . . . . 0.0 110.351 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.53 -41.52 79.8 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.778 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.541 ' HB3' ' H ' ' A' 3584 ' ' ASP . 13.9 t70 -61.94 -40.53 95.87 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.362 177.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' 3584 ' ' ASP . 58.6 t -57.18 -45.04 84.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.271 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.325 178.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 7.1 t -62.31 -53.66 44.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.472 0.653 . . . . 0.0 109.616 -178.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 53.6 m -54.55 -48.88 71.49 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.601 178.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -68.89 -34.28 75.15 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -179.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 87.0 m -61.06 -46.77 89.34 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.851 -0.339 . . . . 0.0 110.115 177.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -64.84 -45.08 87.6 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.979 179.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 70.4 m -53.52 -43.45 68.32 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.736 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.538 HD12 ' HB2' ' A' 3599 ' ' PHE . 53.4 tp -67.86 -44.09 77.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.719 177.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.593 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 49.6 mtpt -57.98 -57.99 10.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.894 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -63.01 -34.68 78.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.606 -177.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.84 -47.43 6.15 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -171.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.538 ' HB2' HD12 ' A' 3595 ' ' LEU . 17.2 m-85 -99.62 -50.75 3.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.736 0.303 . . . . 0.0 111.529 -174.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.4 mm -61.5 -50.88 78.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.424 -176.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 60.4 m -58.73 -50.01 75.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.518 178.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.675 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.2 OUTLIER -59.75 -58.67 7.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.561 -178.913 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.675 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.4 OUTLIER -54.59 -41.35 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -176.679 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -79.28 -37.37 37.97 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.707 -176.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.29 -39.73 81.99 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.007 0.432 . . . . 0.0 111.185 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . 0.448 ' HG3' ' CD1' ' A' 3602 ' ' TYR . 21.6 mmmt -81.51 -15.79 53.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.928 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 52.79 65.42 1.52 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.338 -173.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.623 ' O ' HD12 ' A' 3603 ' ' LEU . . . -146.15 -174.6 4.48 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.916 0.388 . . . . 0.0 111.801 -175.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.724 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -121.81 118.75 29.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.65 177.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . 0.533 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.98 103.15 0.66 Allowed Glycine 0 C--O 1.221 -0.661 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.833 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.652 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 39.7 mm -89.38 120.9 38.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 121.312 0.577 . . . . 0.0 111.092 -174.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.729 HD13 ' HB3' ' A' 3547 ' ' LEU . 32.8 mt -120.52 107.43 20.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.862 176.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.449 ' HA ' ' O ' ' A' 3624 ' ' TYR . 48.9 m-80 -82.54 127.0 32.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.868 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 35.0 m . . . . . 0 C--N 1.321 -0.668 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.618 179.495 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.449 ' O ' ' HA ' ' A' 3613 ' ' ASN . 72.0 m-85 . . . . . 0 CA--C 1.513 -0.48 0 CA-C-O 120.972 0.415 . . . . 0.0 110.419 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.421 HG13 HD12 ' A' 3611 ' ' ILE . 4.5 t -120.5 116.01 48.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.234 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -97.57 111.71 23.87 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 169.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.426 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 39.1 mt-30 -94.76 111.29 23.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.067 -177.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.603 HG12 HG12 ' A' 3659 ' ' ILE . 45.2 mt -89.61 98.91 8.63 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.294 178.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -88.34 139.5 30.18 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.996 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.547 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 47.5 Cg_endo -68.56 172.95 10.59 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.73 2.287 . . . . 0.0 111.765 178.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.03 37.45 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.778 2.318 . . . . 0.0 112.359 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . 0.431 ' H ' ' C ' ' A' 3630 ' ' PRO . 24.4 p -77.71 163.47 26.14 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.908 -178.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -44.67 -40.94 6.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.288 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . 0.443 ' HB2' HD13 ' A' 3560 ' ' LEU . 51.2 t80 -52.67 -51.53 59.83 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 34.4 p -70.08 -54.22 14.03 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.126 -173.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -58.81 -37.66 76.87 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -176.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 15.0 t -62.82 -50.71 69.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.094 0.473 . . . . 0.0 110.341 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -67.71 -32.72 73.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.647 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . 0.435 ' HB3' HD23 ' A' 3647 ' ' LEU . 79.1 mt -63.94 -39.51 94.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.726 176.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . . . . . . . . . 46.6 m -67.21 -26.76 66.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.265 0.555 . . . . 0.0 110.298 178.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 24.9 ttm180 -80.42 -47.52 14.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.759 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.792 HD13 HD22 ' A' 3575 ' ' LEU . 9.9 mt -86.9 -31.82 20.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.908 -170.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.419 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -150.45 73.24 9.07 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -174.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.24 -16.4 48.37 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.723 2.282 . . . . 0.0 111.958 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . 0.598 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 3.9 m-20 -71.92 -55.03 8.22 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.083 -178.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.621 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.5 -30.19 47.03 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.889 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.502 ' HA ' ' CG1' ' A' 3650 ' ' ILE . 3.3 tm? -54.5 -43.2 71.61 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.909 0.385 . . . . 0.0 110.235 177.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.25 -21.69 66.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.511 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 14.7 t -90.1 -31.12 17.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.89 0.376 . . . . 0.0 110.728 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.615 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.0 pt -84.72 -11.4 11.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.768 -175.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 10.7 p -62.78 -20.5 65.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.025 0.441 . . . . 0.0 110.521 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -85.51 -38.05 18.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.254 0.549 . . . . 0.0 109.94 173.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.615 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.1 tp -105.22 41.17 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 122.322 1.058 . . . . 0.0 109.446 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.466 ' N ' ' HD2' ' A' 3655 ' ' PRO . 64.5 m -36.71 -44.51 1.17 Allowed Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 114.26 -1.336 . . . . 0.0 113.837 172.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' 3654 ' ' SER . 12.8 Cg_endo -58.73 88.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.491 1.46 . . . . 0.0 111.744 169.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -157.16 177.67 11.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.343 -177.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.44 HD11 HD11 ' A' 3595 ' ' LEU . 36.3 mt -127.96 139.67 52.44 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.81 -178.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 55.6 ttp -102.48 109.27 20.85 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.886 HD12 HD21 ' A' 3524 ' ' LEU . 79.4 mt -101.21 116.29 44.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-O 121.291 0.567 . . . . 0.0 111.25 -173.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.747 HG13 ' HD2' ' A' 3573 ' ' TYR . 71.7 t -101.6 115.71 43.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.928 -177.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.625 HG12 ' HG ' ' A' 3626 ' ' LEU . 64.9 mt -90.84 112.7 25.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -114.31 127.7 55.99 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.898 0.38 . . . . 0.0 111.599 -177.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 53.0 m -84.42 135.12 34.4 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.008 171.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 5.9 p . . . . . 0 C--O 1.249 1.071 0 CA-C-O 119.008 -0.52 . . . . 0.0 109.67 176.155 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.629 ' CD1' ' HB2' ' A' 3553 ' ' MET . 38.3 m-85 . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 111.501 0.186 . . . . 0.0 111.501 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.577 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 4.9 mm-40 52.38 -152.14 0.26 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.551 0.691 . . . . 0.0 110.788 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 76.3 m -153.27 117.19 4.78 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 169.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.655 HD23 ' NH1' ' A' 3552 ' ' ARG . 0.1 OUTLIER . . . . . 0 CA--C 1.518 -0.264 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.563 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.1 pp . . . . . 0 CA--C 1.53 0.19 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.643 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -69.09 -15.99 63.57 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 118.502 0.592 . . . . 0.0 110.872 -172.26 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.646 ' HA ' ' HE2' ' A' 3503 ' ' LYS . 7.7 mmpt? -78.51 -15.61 58.4 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.969 0.414 . . . . 0.0 109.921 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -101.02 -43.69 5.96 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 174.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.707 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.7 103.65 3.05 Favored Pre-proline 0 N--CA 1.443 -0.789 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.715 179.786 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -84.0 174.97 7.96 Favored 'Trans proline' 0 CA--C 1.531 0.373 0 C-N-CA 124.381 3.387 . . . . 0.0 113.705 -176.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.439 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 93.0 mt -70.63 139.41 20.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.044 179.241 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 27.4 m -107.17 -26.27 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.357 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.778 ' HE3' HD12 ' A' 3524 ' ' LEU . 61.2 t90 -153.87 145.41 23.21 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -142.42 120.02 11.78 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.98 -128.19 1.01 Allowed Glycine 0 N--CA 1.442 -0.942 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -178.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.624 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.0 mp -139.45 151.84 46.55 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.051 0.453 . . . . 0.0 110.901 179.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.47 HD23 ' HB2' ' A' 3547 ' ' LEU . 78.6 mt -105.74 146.03 30.35 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 168.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.661 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -141.47 123.39 15.37 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.755 -176.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.723 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.15 146.49 40.69 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 173.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.723 ' CD ' HD12 ' A' 3515 ' ' LEU . 1.1 mptm? 59.17 -92.91 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.179 0.592 . . . . 0.0 110.549 -171.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 10.0 m120 -142.08 4.98 1.68 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.187 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -103.02 135.73 44.17 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.384 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.523 HG22 ' HB2' ' A' 3514 ' ' ALA . 7.2 p -116.31 132.25 56.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.867 177.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -124.27 112.86 17.51 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.71 176.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.624 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.78 121.32 17.8 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.434 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -132.64 147.79 31.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.733 0.777 . . . . 0.0 111.911 -175.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -108.31 124.92 51.07 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.787 173.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.851 HD21 HD12 ' A' 3659 ' ' ILE . 1.4 mt -94.38 108.77 20.67 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.718 -175.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.439 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 83.7 m-70 -85.66 136.93 33.17 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.826 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.707 ' O ' ' HB2' ' A' 3505 ' ' TYR . 68.0 t80 -67.23 137.77 56.43 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.585 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.5 t -114.94 -56.43 4.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.53 0.681 . . . . 0.0 110.565 175.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 57.7 m -163.57 173.06 13.49 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.549 -171.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . 0.442 ' HA3' ' HA ' ' A' 3574 ' ' CYS . . . 90.78 -165.0 30.5 Favored Glycine 0 C--O 1.229 -0.2 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.253 177.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.569 ' HB2' ' HA ' ' A' 3571 ' ' THR . 49.2 t30 -92.72 108.48 20.02 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.618 0.247 . . . . 0.0 110.539 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 7.8 p30 -61.12 -25.02 66.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.405 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 59.2 t -62.5 -32.87 56.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.947 0.403 . . . . 0.0 110.422 178.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.459 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 24.9 mt -60.52 -39.39 87.62 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.603 177.142 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.475 ' HB1' HD12 ' A' 3538 ' ' LEU . . . -67.69 -40.95 84.32 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-O 120.72 0.295 . . . . 0.0 110.611 -178.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -59.59 -41.63 90.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.856 178.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -89.32 -7.74 54.73 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -174.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.566 ' HB2' HD11 ' A' 3626 ' ' LEU . 66.7 p -104.36 -41.6 5.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.086 0.47 . . . . 0.0 110.876 178.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.71 HD13 ' HB2' ' A' 3509 ' ' TRP . 25.7 mt -80.31 113.64 40.65 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.627 -178.045 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo . . . . . 0 N--CA 1.452 -0.931 0 C-N-CA 122.39 2.06 . . . . 0.0 112.415 -176.271 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 N--CA 1.459 -0.541 0 N-CA-C 111.613 -0.187 . . . . 0.0 111.613 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.688 ' HB3' HD13 ' A' 3612 ' ' ILE . 36.0 mt -68.95 112.11 5.4 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.661 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -95.5 138.61 32.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.033 0.444 . . . . 0.0 110.792 -177.101 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.491 ' HA ' HG12 ' A' 3612 ' ' ILE . 17.9 mt -90.54 107.7 18.77 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 CA-C-O 122.155 0.979 . . . . 0.0 111.145 -174.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.422 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -106.99 -5.78 17.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.722 -1.126 . . . . 0.0 111.913 -172.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.664 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 85.0 mt-30 -150.92 175.65 11.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.654 0.264 . . . . 0.0 111.004 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.751 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -149.92 138.9 21.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.049 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.76 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 22.0 ttt -109.77 107.73 17.83 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.276 175.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 34.6 mtm180 -60.09 110.73 1.28 Allowed 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.804 0.335 . . . . 0.0 110.127 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.526 ' HB2' HD21 ' A' 3560 ' ' LEU . 1.8 pp -76.58 97.33 4.36 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.164 0.983 . . . . 0.0 109.863 -176.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.592 ' O ' ' HG ' ' A' 3560 ' ' LEU . 31.4 mt-10 -106.54 168.86 8.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.595 178.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.479 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.73 -50.57 68.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.724 0.297 . . . . 0.0 110.62 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 8.2 p -60.94 -40.89 94.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.389 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.583 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 77.8 mm-40 -66.31 -42.69 87.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.103 -177.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' 3556 ' ' GLU . 84.3 mt -60.39 -35.31 75.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.751 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' 3557 ' ' ALA . 15.0 mm-40 -59.89 -46.33 89.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.093 174.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -63.0 -38.76 97.14 Favored Glycine 0 N--CA 1.452 -0.247 0 CA-C-N 115.437 -0.802 . . . . 0.0 112.337 177.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.58 ' O ' ' HG3' ' A' 3567 ' ' MET . 62.1 t -62.02 -54.26 36.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.623 0.249 . . . . 0.0 110.429 177.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -60.87 -29.79 69.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.865 0.364 . . . . 0.0 111.11 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.429 ' O ' HG22 ' A' 3568 ' ' THR . 3.0 tmt_? -59.93 -42.5 94.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.58 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -87.65 -10.34 51.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.197 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.58 ' HG3' ' O ' ' A' 3563 ' ' VAL . 85.9 mtp -85.24 -18.91 32.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.813 0.339 . . . . 0.0 111.413 -179.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . 0.429 HG22 ' O ' ' A' 3565 ' ' ARG . 12.0 t -82.96 -7.35 59.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.03 0.443 . . . . 0.0 110.529 -178.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 55.2 t -117.65 93.83 2.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-O 121.043 0.449 . . . . 0.0 110.202 178.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -74.67 108.11 7.21 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.569 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.8 m 154.59 -41.66 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.482 1.513 . . . . 0.0 107.669 -172.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -87.01 -26.11 23.92 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.179 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.853 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -132.62 163.56 28.63 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.931 177.472 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.618 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 42.1 t -128.29 136.63 51.26 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 170.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.804 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.2 126.11 51.73 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.609 HD11 HD11 ' A' 3661 ' ' ILE . 79.4 mt -127.87 153.85 46.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.904 -177.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.757 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -119.56 108.23 14.25 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.415 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.515 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.18 120.71 34.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.39 0.614 . . . . 0.0 110.337 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.564 ' HG ' HD12 ' A' 3577 ' ' LEU . 62.5 mt -123.09 145.32 45.69 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.855 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.62 126.73 22.16 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.377 2.051 . . . . 0.0 112.213 179.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 31.5 p -119.14 116.46 26.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.111 0.481 . . . . 0.0 109.871 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.32 146.05 16.39 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.464 -0.874 . . . . 0.0 112.23 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . 0.421 ' HE ' ' CG ' ' A' 3587 ' ' ASP . 36.3 mtm180 -59.64 -46.79 87.94 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.444 0.64 . . . . 0.0 109.771 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.572 ' O ' HG23 ' A' 3588 ' ' VAL . 4.8 m-20 -132.12 177.06 7.85 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.564 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -55.58 -43.0 75.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.931 0.396 . . . . 0.0 110.558 179.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.09 -46.5 90.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.246 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.534 ' O ' ' HG2' ' A' 3591 ' ' GLN . 15.0 t70 -63.47 -40.88 98.3 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.001 -178.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' 3584 ' ' ASP . 72.1 t -53.85 -47.18 63.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.774 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 94.2 t -60.62 -46.5 95.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.304 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 46.8 t -62.61 -44.94 95.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.404 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' 3587 ' ' ASP . 72.1 mm-40 -64.35 -42.0 96.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.762 0.315 . . . . 0.0 110.287 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . 0.424 ' O ' ' HG3' ' A' 3596 ' ' LYS . 57.8 m -59.63 -53.45 57.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.861 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' 3596 ' ' LYS . 11.2 pt-20 -65.5 -35.07 79.8 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 121.044 -0.263 . . . . 0.0 111.638 -177.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 38.1 m -65.43 -44.17 88.18 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.519 HD12 ' HB2' ' A' 3599 ' ' PHE . 53.3 tp -63.01 -44.76 95.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.476 178.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.572 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 58.9 mtpt -56.4 -58.18 9.1 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.67 177.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.44 -33.46 75.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.702 -175.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.597 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.62 -46.44 6.63 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -171.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.519 ' HB2' HD12 ' A' 3595 ' ' LEU . 19.8 m-85 -99.71 -50.46 4.04 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.79 0.329 . . . . 0.0 111.339 -173.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.572 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 23.4 mm -62.61 -52.6 57.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.032 -176.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 75.3 m -59.49 -45.25 92.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.037 178.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.718 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -66.6 -56.34 11.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.568 -178.14 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.718 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -55.18 -44.3 75.12 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -175.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -73.85 -34.23 64.42 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.685 -176.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.76 -38.4 80.07 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.207 0.527 . . . . 0.0 110.646 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -77.69 -18.64 56.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.445 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 50.72 53.74 12.45 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.484 -169.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.584 ' O ' HD12 ' A' 3603 ' ' LEU . . . -136.26 -175.53 4.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.734 -172.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.76 ' HB3' ' HB3' ' A' 3553 ' ' MET . . . -120.47 121.33 38.24 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.678 177.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . 0.521 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.92 101.53 0.49 Allowed Glycine 0 C--O 1.222 -0.654 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.142 177.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.664 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 29.3 mm -89.97 125.58 42.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.192 0.52 . . . . 0.0 110.928 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.688 HD13 ' HB3' ' A' 3547 ' ' LEU . 41.1 mt -124.63 117.32 50.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.714 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 11.4 m120 -83.34 141.81 31.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.285 -175.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.527 HG11 ' HA ' ' A' 3537 ' ' SER . 58.8 t . . . . . 0 C--N 1.326 -0.415 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.458 178.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.516 ' HB2' ' O ' ' A' 3614 ' ' VAL . 68.0 m-85 . . . . . 0 CA--C 1.502 -0.885 0 CA-C-O 121.441 0.639 . . . . 0.0 109.6 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.564 HG12 ' HG3' ' A' 3627 ' ' GLN . 6.1 t -131.67 113.18 22.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.016 -176.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.659 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -92.31 111.52 23.12 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 171.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.564 ' HG3' HG12 ' A' 3625 ' ' VAL . 50.2 mt-30 -94.33 110.28 22.05 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.757 -177.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.606 HG12 HG12 ' A' 3659 ' ' ILE . 46.8 mt -93.72 97.66 7.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.184 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -87.92 143.64 33.6 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.905 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.466 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 42.9 Cg_endo -67.58 171.07 12.49 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.554 2.169 . . . . 0.0 111.396 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.52 41.66 0.53 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 122.844 2.363 . . . . 0.0 112.816 178.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 15.4 p -75.7 161.7 28.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.919 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . 0.427 ' OE2' ' HB2' ' A' 3637 ' ' SER . 4.4 tm-20 -48.85 -44.23 39.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.763 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 21.3 t80 -49.38 -49.85 42.85 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.477 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.5 m -63.56 -54.96 27.89 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.962 -177.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . 0.432 ' HA ' HD12 ' A' 3639 ' ' LEU . 3.7 mm-40 -62.5 -34.25 76.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.993 -175.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . 0.427 ' HB2' ' OE2' ' A' 3633 ' ' GLU . 34.2 t -61.22 -50.52 72.76 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.701 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . 0.408 ' HB3' HD12 ' A' 3642 ' ' LEU . 38.9 m-70 -65.28 -35.46 81.08 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.066 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . 0.446 HD13 HD12 ' A' 3650 ' ' ILE . 88.5 mt -63.89 -39.2 93.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.977 177.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 1.034 ' HA ' HD22 ' A' 3647 ' ' LEU . 33.6 t -59.72 -37.52 79.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.173 0.511 . . . . 0.0 110.718 177.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 31.6 mtp180 -83.88 -37.66 22.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.28 -179.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.804 HD13 HD22 ' A' 3575 ' ' LEU . 23.5 mt -87.69 -31.13 19.88 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -172.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.439 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -154.66 87.34 3.43 Favored Pre-proline 0 N--CA 1.465 0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 111.659 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -74.76 -21.75 16.12 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 122.577 2.185 . . . . 0.0 113.783 -175.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.25 -53.09 10.48 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.394 -0.523 . . . . 0.0 109.842 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.757 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -71.06 -26.44 63.08 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 1.034 HD22 ' HA ' ' A' 3640 ' ' SER . 25.2 tp -53.27 -49.69 66.4 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.353 175.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -58.1 -27.2 63.48 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.016 0.436 . . . . 0.0 110.846 -178.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 13.6 m -77.85 -45.15 25.14 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.243 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.626 ' HA ' HG22 ' A' 3653 ' ' ILE . 3.8 pt -73.87 -20.13 17.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.82 0.343 . . . . 0.0 111.566 -175.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.5 m -58.09 -28.21 64.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.968 0.413 . . . . 0.0 110.309 175.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -88.51 -34.5 17.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.737 175.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.626 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.3 tp -104.99 42.68 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 122.662 1.22 . . . . 0.0 109.014 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.492 ' N ' ' HD2' ' A' 3655 ' ' PRO . 5.4 p -40.1 -38.0 0.95 Allowed Pre-proline 0 CA--C 1.54 0.587 0 CA-C-N 113.61 -1.632 . . . . 0.0 114.216 172.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' 3654 ' ' SER . 19.4 Cg_endo -62.95 78.57 0.11 Allowed 'Trans proline' 0 C--N 1.359 1.113 0 CA-C-N 120.832 1.333 . . . . 0.0 111.415 169.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . 0.469 ' HB2' HD23 ' A' 3579 ' ' LEU . 20.5 p80 -148.19 176.17 10.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.061 -177.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.486 HD22 HG22 ' A' 3628 ' ' ILE . 28.0 mt -122.49 152.34 40.41 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.204 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 13.4 tmm? -115.34 113.24 23.54 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 175.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.851 HD12 HD21 ' A' 3524 ' ' LEU . 80.9 mt -107.55 123.2 62.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.35 0.595 . . . . 0.0 111.971 -170.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.853 HG13 ' HD2' ' A' 3573 ' ' TYR . 78.9 t -108.25 112.7 41.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.644 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.659 HG12 ' HG ' ' A' 3626 ' ' LEU . 58.1 mt -90.57 112.33 24.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -128.35 143.46 51.01 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.437 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 14.6 m -94.42 107.97 19.91 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 42.8 t . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.455 -0.783 . . . . 0.0 110.193 -178.311 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.531 ' CD1' ' HB2' ' A' 3553 ' ' MET . 64.7 m-85 . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 119.677 -0.201 . . . . 0.0 111.403 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.621 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.8 OUTLIER 56.93 -160.9 0.22 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.526 0.679 . . . . 0.0 111.391 179.233 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.417 ' H ' ' HB3' ' B' 2519 ' ' GLU . 19.2 m -146.53 115.9 7.07 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 166.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.561 HD13 ' HD2' ' A' 3552 ' ' ARG . 20.3 tp . . . . . 0 N--CA 1.454 -0.254 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.817 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.578 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp . . . . . 0 C--O 1.226 -0.144 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.603 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.27 -15.55 62.92 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.818 -175.91 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.603 ' N ' HD13 ' A' 3502 ' ' LEU . 18.9 ttpp -65.21 -25.14 67.57 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.563 176.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -105.57 -42.14 5.28 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.745 175.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.671 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.27 108.75 3.19 Favored Pre-proline 0 CA--C 1.536 0.411 0 CA-C-O 121.38 0.609 . . . . 0.0 111.445 -178.624 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -85.49 174.54 6.79 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 124.221 3.281 . . . . 0.0 113.798 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.517 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.6 mt -72.14 134.46 29.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.03 -179.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.444 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.5 m -101.25 -31.92 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.504 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.638 ' CB ' HD13 ' A' 3538 ' ' LEU . 34.8 t-105 -149.08 152.53 36.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.745 0.307 . . . . 0.0 110.566 -177.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -145.51 118.18 8.62 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 175.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.75 -134.51 1.72 Allowed Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.61 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -139.76 151.35 45.73 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.296 0.569 . . . . 0.0 111.532 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.478 HD23 ' HB2' ' A' 3547 ' ' LEU . 73.9 mt -105.45 151.97 23.58 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 170.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.677 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.91 125.15 12.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.644 0.259 . . . . 0.0 111.572 -178.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.753 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.97 142.9 40.48 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 173.966 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.753 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 57.47 -93.39 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.496 0.497 . . . . 0.0 109.755 -169.838 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -140.65 7.33 2.1 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.42 ' HB3' ' HB1' ' A' 3598 ' ' ALA . 7.3 m-20 -95.09 144.14 25.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.059 -174.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 17.8 p -132.28 144.12 50.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.963 0.411 . . . . 0.0 111.472 -177.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -139.63 113.82 8.94 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.774 175.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.61 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.29 112.82 9.7 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 26.9 m -125.06 147.78 29.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.623 0.725 . . . . 0.0 112.237 -173.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . 0.523 HE21 ' HB3' ' A' 3581 ' ' CYS . 10.6 pt20 -106.03 132.72 51.78 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.604 -1.18 . . . . 0.0 108.577 172.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.855 HD21 HD12 ' A' 3659 ' ' ILE . 1.1 mt -104.66 109.11 20.91 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.437 0.637 . . . . 0.0 111.738 -175.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.517 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 76.3 m-70 -84.42 138.44 32.83 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.106 -0.952 . . . . 0.0 108.638 175.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.671 ' O ' ' HB2' ' A' 3505 ' ' TYR . 61.5 t80 -68.05 137.46 55.05 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 174.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.552 ' CG1' HD23 ' A' 3575 ' ' LEU . 19.8 t -114.8 -56.76 4.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.281 0.562 . . . . 0.0 111.1 177.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . . . . . . . . . 22.7 t -160.57 171.5 18.84 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.422 -173.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.45 -148.02 20.36 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.719 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.592 ' HB2' ' HA ' ' A' 3571 ' ' THR . 38.1 t30 -108.63 116.77 32.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.744 0.307 . . . . 0.0 110.975 -178.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -68.67 -23.53 64.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.167 -176.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . 0.451 ' O ' ' HG2' ' A' 3536 ' ' ARG . 90.0 t -59.71 -36.29 64.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.876 0.37 . . . . 0.0 110.313 177.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.51 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 59.1 mt -59.33 -37.42 77.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.874 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.43 ' HB1' ' CD1' ' A' 3538 ' ' LEU . . . -69.47 -41.4 76.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.619 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 15.6 t60 -60.39 -36.26 77.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.151 -177.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' 3532 ' ' VAL . 12.5 ptp180 -89.13 -26.66 21.21 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.2 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.626 ' O ' HG11 ' A' 3614 ' ' VAL . 72.8 p -86.72 -38.94 16.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.119 0.485 . . . . 0.0 110.904 -178.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.638 HD13 ' CB ' ' A' 3509 ' ' TRP . 22.0 mt -81.51 123.57 80.83 Favored Pre-proline 0 C--N 1.316 -0.855 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' 3538 ' ' LEU . 6.2 Cg_endo . . . . . 0 N--CA 1.448 -1.154 0 C-N-CA 121.801 1.667 . . . . 0.0 111.383 -178.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo . . . . . 0 N--CA 1.462 -0.328 0 CA-C-O 121.1 0.375 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.689 ' HB3' HD13 ' A' 3612 ' ' ILE . 49.9 mt -81.82 112.74 19.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.261 177.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.677 ' HA ' ' O ' ' A' 3514 ' ' ALA . 21.7 ptt85 -90.34 141.51 28.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.871 0.367 . . . . 0.0 111.196 -177.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.522 HG22 HD12 ' B' 2521 ' ' LEU . 20.2 mt -95.02 107.14 19.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.865 0.841 . . . . 0.0 110.636 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.476 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -110.83 -4.15 15.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.594 -172.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.66 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 52.9 mt-30 -150.97 176.49 11.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.955 -0.111 . . . . 0.0 111.022 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.768 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -160.38 140.13 11.13 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -177.78 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.579 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -112.4 125.21 53.96 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.72 -0.218 . . . . 0.0 110.641 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' 3554 ' ' ARG . 13.6 mmt85 -68.82 110.3 4.29 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.597 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -72.35 98.57 2.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 122.293 1.045 . . . . 0.0 110.318 -175.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.58 ' O ' ' HG ' ' A' 3560 ' ' LEU . 37.8 mt-10 -106.24 156.88 18.02 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.492 177.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.503 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -53.96 -50.24 66.95 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.125 0.266 . . . . 0.0 111.295 -177.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 18.7 p -63.98 -42.54 97.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.905 0.383 . . . . 0.0 111.246 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.505 ' O ' HG23 ' A' 3563 ' ' VAL . 80.9 mm-40 -61.37 -42.46 98.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.078 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.58 HD21 ' HB2' ' A' 3555 ' ' LEU . 94.0 mt -65.18 -31.9 73.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.199 -178.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' 3557 ' ' ALA . 22.4 mm-40 -66.78 -45.27 79.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.214 0.53 . . . . 0.0 109.636 175.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -57.66 -41.75 93.89 Favored Glycine 0 CA--C 1.519 0.291 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.036 174.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.581 ' O ' ' HG3' ' A' 3567 ' ' MET . 97.1 t -61.94 -46.75 95.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.843 0.354 . . . . 0.0 110.207 177.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -62.61 -25.48 68.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.541 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.464 ' O ' HG22 ' A' 3568 ' ' THR . 41.5 ttm105 -63.61 -34.58 78.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.64 178.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . 0.549 ' HG2' ' O ' ' A' 3563 ' ' VAL . 10.5 ptp180 -86.45 -18.97 30.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.19 0.519 . . . . 0.0 109.889 176.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.581 ' HG3' ' O ' ' A' 3563 ' ' VAL . 90.0 mtp -75.44 -22.29 57.47 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.917 -177.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . 0.464 HG22 ' O ' ' A' 3565 ' ' ARG . 6.1 t -80.22 -8.65 59.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.126 0.489 . . . . 0.0 110.25 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.4 t -113.16 89.65 1.34 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.354 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.91 110.45 6.42 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.072 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.592 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 3.3 m 147.48 -39.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.894 1.677 . . . . 0.0 107.819 -177.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.02 -30.79 44.4 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.665 -179.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.806 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -133.43 167.14 20.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.068 178.464 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.637 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 35.2 t -128.11 137.06 51.97 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 172.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.763 HD22 HD13 ' A' 3642 ' ' LEU . 14.1 tp -106.43 125.52 51.1 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.622 HD11 HD11 ' A' 3661 ' ' ILE . 80.3 mt -128.23 155.22 44.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.177 0.513 . . . . 0.0 110.899 -177.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.729 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -122.12 108.53 13.45 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.407 179.367 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.465 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -95.0 125.91 39.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.289 0.566 . . . . 0.0 110.706 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.51 HD23 ' HB2' ' A' 3656 ' ' HIS . 75.3 mt -125.24 144.44 47.48 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.242 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -61.87 112.22 1.44 Allowed 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.347 2.031 . . . . 0.0 111.874 178.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . 0.523 ' HB3' HE21 ' A' 3523 ' ' GLN . 26.4 p -104.7 120.61 41.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.868 0.366 . . . . 0.0 110.345 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . 0.4 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.07 145.17 16.19 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.849 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -67.13 -38.55 85.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.743 0.782 . . . . 0.0 109.465 176.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.598 ' O ' HG23 ' A' 3588 ' ' VAL . 29.1 t70 -136.73 169.68 17.34 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.524 -1.216 . . . . 0.0 107.808 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -56.65 -37.1 70.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.287 0.494 . . . . 0.0 110.512 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -60.72 -46.55 89.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.285 0.564 . . . . 0.0 109.509 176.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.439 ' HB3' ' H ' ' A' 3584 ' ' ASP . 23.4 t70 -64.37 -42.54 96.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.785 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' 3584 ' ' ASP . 89.6 t -54.76 -47.49 74.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.776 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 87.8 t -58.95 -49.44 83.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.385 178.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 23.0 t -60.07 -48.91 79.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.765 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -63.37 -37.83 88.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.859 -0.155 . . . . 0.0 111.413 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 66.5 m -61.51 -52.0 66.28 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.068 0.461 . . . . 0.0 110.484 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.521 ' HA ' ' HG2' ' A' 3596 ' ' LYS . 26.9 mt-10 -68.55 -38.66 80.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.886 -179.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 18.3 t -58.03 -49.65 76.14 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.136 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.572 HD12 ' HB2' ' A' 3599 ' ' PHE . 57.8 tp -62.5 -46.69 87.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.327 -178.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.818 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 65.7 pttt -70.35 -33.85 71.95 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.143 -175.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -77.82 -37.34 48.84 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 121.041 -0.264 . . . . 0.0 111.709 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.42 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -91.96 -46.95 7.55 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -172.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.572 ' HB2' HD12 ' A' 3595 ' ' LEU . 14.8 m-85 -98.7 -49.74 4.49 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.637 0.256 . . . . 0.0 111.294 -174.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.818 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 25.1 mm -60.55 -55.31 25.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.708 -178.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 64.2 m -57.63 -38.46 75.03 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.208 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.744 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -68.84 -57.11 6.02 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.866 178.522 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.744 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.22 -41.91 76.4 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.569 0.223 . . . . 0.0 111.55 -177.212 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -72.05 -36.93 69.76 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.703 -177.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.33 -36.95 80.04 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.053 0.454 . . . . 0.0 110.758 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -79.61 -18.31 51.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.87 178.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . 0.537 ' O ' ' HG ' ' A' 3555 ' ' LEU . 22.7 mt-30 51.92 48.31 23.02 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -171.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.574 ' O ' HD12 ' A' 3603 ' ' LEU . . . -130.24 -175.93 3.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.295 -171.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.768 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.71 117.73 28.24 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.499 175.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . 0.439 ' N ' HD11 ' A' 3603 ' ' LEU . . . -66.21 105.4 1.27 Allowed Glycine 0 C--O 1.222 -0.641 0 C-N-CA 120.837 -0.696 . . . . 0.0 111.896 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.66 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 35.4 mm -89.69 125.91 42.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.223 0.535 . . . . 0.0 111.22 -175.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.689 HD13 ' HB3' ' A' 3547 ' ' LEU . 28.1 mt -121.23 114.72 44.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.302 178.001 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.533 ' HA ' ' O ' ' A' 3624 ' ' TYR . 12.9 m120 -88.74 127.96 35.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.359 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.626 HG11 ' O ' ' A' 3537 ' ' SER . 4.8 t . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.187 -177.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.533 ' O ' ' HA ' ' A' 3613 ' ' ASN . 72.7 m-85 . . . . . 0 CA--C 1.513 -0.473 0 CA-C-O 121.044 0.449 . . . . 0.0 110.506 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.406 HG13 HG23 ' A' 3611 ' ' ILE . 4.3 t -126.67 114.07 36.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.851 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.619 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -98.42 114.88 27.4 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 169.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.515 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 65.4 mt-30 -94.5 110.92 22.68 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.605 HG12 HG12 ' A' 3659 ' ' ILE . 39.2 mt -92.38 98.7 8.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.279 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -88.55 142.59 31.2 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.917 177.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.507 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 48.2 Cg_endo -68.98 172.96 10.96 Favored 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 122.578 2.185 . . . . 0.0 111.308 176.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . 0.401 ' HD3' HD12 ' A' 3600 ' ' ILE . 56.4 Cg_endo -70.35 45.23 0.51 Allowed 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.078 2.519 . . . . 0.0 112.276 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.7 p -84.39 163.35 19.57 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.982 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -42.62 -49.85 5.47 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 123.959 0.787 . . . . 0.0 112.02 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . 0.506 ' HB2' HD13 ' A' 3560 ' ' LEU . 38.6 t80 -50.82 -48.12 59.82 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 123.339 0.399 . . . . 0.0 111.487 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.7 m -68.15 -58.43 4.47 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.629 -176.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -60.93 -41.15 95.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.427 -173.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 9.0 t -66.19 -44.97 82.42 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 120.927 0.394 . . . . 0.0 110.243 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 19.7 m80 -68.87 -30.13 68.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.629 178.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 68.9 mt -66.01 -40.66 91.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.846 175.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.475 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 32.7 t -67.1 -25.55 66.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.15 0.5 . . . . 0.0 110.181 177.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -83.86 -38.6 20.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.189 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.763 HD13 HD22 ' A' 3575 ' ' LEU . 12.7 mt -94.91 -31.4 13.69 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -172.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -149.08 75.27 9.82 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -175.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -67.91 -18.75 46.77 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.788 2.325 . . . . 0.0 111.782 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . 0.531 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 2.7 m-20 -71.11 -49.95 38.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.196 -177.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.729 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -83.05 -29.11 29.1 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.444 178.818 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.475 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.35 -43.83 71.64 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.97 0.414 . . . . 0.0 110.45 179.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -67.14 -18.46 65.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.233 -0.44 . . . . 0.0 112.098 -176.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 89.1 p -91.49 -26.19 18.92 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.227 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.627 ' HA ' HG22 ' A' 3653 ' ' ILE . 7.1 pt -88.07 -10.44 10.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.558 -177.03 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.2 p -58.58 -23.93 59.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.875 175.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 5.3 t30 -85.9 -36.51 19.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.094 0.473 . . . . 0.0 110.206 175.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.627 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.4 tp -104.47 38.95 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 122.379 1.085 . . . . 0.0 109.789 -178.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.442 ' N ' ' HD2' ' A' 3655 ' ' PRO . 50.7 m -36.78 -42.24 0.81 Allowed Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 114.157 -1.383 . . . . 0.0 113.947 170.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.451 ' HG2' HD12 ' A' 3653 ' ' ILE . 12.9 Cg_endo -59.75 77.44 0.06 OUTLIER 'Trans proline' 0 C--N 1.357 1.008 0 C-N-CA 121.533 1.489 . . . . 0.0 111.517 168.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . 0.51 ' HB2' HD23 ' A' 3579 ' ' LEU . 22.5 p80 -147.69 174.89 11.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.776 -177.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.479 HD22 HG22 ' A' 3628 ' ' ILE . 42.9 mt -120.76 149.85 41.91 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.525 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 16.2 tmm? -113.98 114.54 26.31 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.855 HD12 HD21 ' A' 3524 ' ' LEU . 74.8 mt -108.38 121.22 61.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.169 0.509 . . . . 0.0 111.811 -170.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.806 HG13 ' HD2' ' A' 3573 ' ' TYR . 76.1 t -105.34 114.77 45.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.918 -178.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.637 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 57.5 mt -91.15 118.45 36.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.314 178.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.5 127.66 55.77 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.654 0.264 . . . . 0.0 110.615 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . 0.421 ' HB2' HD22 ' A' 3533 ' ' LEU . 33.6 t -91.73 122.35 34.2 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.41 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 C--O 1.251 1.154 0 CA-C-O 117.337 -1.316 . . . . 0.0 112.693 178.221 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.579 ' CD1' ' HB2' ' A' 3553 ' ' MET . 8.9 m-85 . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 111.619 0.229 . . . . 0.0 111.619 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.613 ' O ' ' HG2' ' A' 3551 ' ' GLN . 4.5 tt0 58.44 -155.81 0.34 Allowed 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.571 ' H ' ' CG ' ' B' 2519 ' ' GLU . 58.5 m -155.07 121.87 5.42 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 175.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.588 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.584 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp . . . . . 0 C--O 1.227 -0.086 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.655 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -69.4 -15.32 63.27 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.131 0.491 . . . . 0.0 110.163 -172.582 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.655 ' N ' HD13 ' A' 3502 ' ' LEU . 21.6 tptm -77.9 -25.92 48.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.491 ' HG3' ' OD2' ' A' 3645 ' ' ASP . 31.5 mmtp -89.44 -43.14 11.07 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.706 175.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.733 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -153.74 104.17 2.51 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.18 179.598 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -84.01 174.12 8.58 Favored 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 124.085 3.19 . . . . 0.0 114.091 -174.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.511 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.8 mt -71.39 135.69 27.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.115 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.414 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.7 m -104.75 -29.57 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.292 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.717 ' HE3' HD12 ' A' 3524 ' ' LEU . 45.4 t90 -150.02 155.36 39.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -150.9 127.12 10.57 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . 177.93 -125.81 1.03 Allowed Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.539 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.668 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.3 mp -141.01 158.54 43.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.089 0.471 . . . . 0.0 111.098 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.51 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 79.7 mt -112.05 152.55 28.07 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 169.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.62 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.85 123.31 12.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.802 0.334 . . . . 0.0 111.836 -177.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.782 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.42 142.12 39.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 172.957 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.782 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 60.4 -91.6 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 122.788 0.435 . . . . 0.0 110.034 -171.385 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 45.7 m-80 -142.98 7.04 1.6 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.16 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -99.73 138.04 37.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.714 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.515 HG22 ' HB2' ' A' 3514 ' ' ALA . 15.3 p -128.86 127.82 42.63 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.748 -177.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -119.96 120.88 37.64 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.745 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.638 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -75.48 117.05 16.86 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.414 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 30.2 m -129.95 148.36 33.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.417 0.627 . . . . 0.0 111.974 -174.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -110.29 128.71 55.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.259 -0.882 . . . . 0.0 108.872 172.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.866 HD21 HD12 ' A' 3659 ' ' ILE . 1.5 mt -95.6 113.02 24.62 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.186 -174.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.527 ' CE1' HD12 ' A' 3579 ' ' LEU . 70.2 m80 -88.45 141.79 28.25 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.785 175.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.733 ' O ' ' HB2' ' A' 3505 ' ' TYR . 64.3 t80 -71.77 139.71 49.15 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 172.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.582 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.4 t -115.23 -57.59 3.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.461 0.648 . . . . 0.0 110.719 176.081 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.521 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 68.9 m -159.42 171.77 19.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.175 -171.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.57 -149.06 20.33 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.792 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.482 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.4 t-20 -104.64 110.55 22.91 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.211 0.204 . . . . 0.0 110.664 -177.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.9 p30 -63.17 -30.93 71.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.538 -176.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 19.1 t -59.92 -33.47 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.88 0.372 . . . . 0.0 110.028 -179.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' A' 3530 ' ' ASN . 17.8 mt -56.71 -48.33 77.96 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.235 175.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.445 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.13 -38.23 89.95 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.413 0.625 . . . . 0.0 110.23 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -62.52 -40.21 96.03 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.27 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' 3536 ' ' ARG . 11.4 ptt180 -89.38 -10.01 48.19 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -179.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.427 ' HB2' HD11 ' A' 3626 ' ' LEU . 29.8 p -98.9 -41.82 7.43 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 122.015 -0.428 . . . . 0.0 111.506 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.683 HD13 ' HB2' ' A' 3509 ' ' TRP . 29.8 mt -78.84 111.27 18.4 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-O 121.142 0.496 . . . . 0.0 110.063 -173.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo . . . . . 0 N--CA 1.46 -0.445 0 C-N-CA 123.078 2.519 . . . . 0.0 112.474 -172.974 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . 0.668 ' HA ' ' O ' ' A' 3512 ' ' LEU . 33.8 Cg_endo . . . . . 0 N--CA 1.462 -0.338 0 CA-C-O 120.922 0.301 . . . . 0.0 112.52 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.662 ' HB3' HD13 ' A' 3612 ' ' ILE . 24.4 mt -69.05 115.42 8.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.795 174.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.62 ' HA ' ' O ' ' A' 3514 ' ' ALA . 20.0 ptt180 -90.31 138.64 31.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.06 -176.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.47 ' O ' ' HB3' ' B' 2521 ' ' LEU . 20.8 mt -95.26 106.96 18.87 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 CA-C-O 122.152 0.977 . . . . 0.0 110.865 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.509 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.38 -2.05 14.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.581 -1.191 . . . . 0.0 111.695 -173.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.699 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 16.1 mt-30 -151.13 174.44 13.21 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.459 0.171 . . . . 0.0 111.331 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.75 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -157.0 136.43 12.15 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.357 -177.874 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.574 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 11.7 tmm? -110.03 121.11 44.48 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.288 177.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . 0.436 HH11 ' HD2' ' A' 3554 ' ' ARG . 9.3 mmt180 -63.3 111.35 2.23 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.542 ' HB2' HD21 ' A' 3560 ' ' LEU . 2.9 pp -71.84 97.32 1.79 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 122.472 1.13 . . . . 0.0 108.683 178.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.484 ' H ' ' HB2' ' A' 3559 ' ' GLN . 6.0 mm-40 -103.9 163.86 12.08 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.498 -177.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -58.45 -45.89 87.66 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.224 0.328 . . . . 0.0 110.18 176.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 44.8 p -66.07 -41.86 90.17 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.107 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.583 ' O ' HG23 ' A' 3563 ' ' VAL . 15.4 mm100 -63.45 -49.71 72.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.13 -179.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.542 HD21 ' HB2' ' A' 3555 ' ' LEU . 79.7 mt -59.69 -37.51 79.02 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.512 -176.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' 3557 ' ' ALA . 7.4 mm-40 -56.58 -53.35 58.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.961 0.41 . . . . 0.0 110.06 175.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -60.89 -41.11 99.15 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.199 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' 3559 ' ' GLN . 91.9 t -60.52 -52.78 57.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.448 0.166 . . . . 0.0 110.635 178.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.5 91.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.787 0.327 . . . . 0.0 111.293 -178.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.541 ' O ' HG22 ' A' 3568 ' ' THR . 98.1 mtt180 -68.05 -27.26 66.37 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.595 -177.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -88.42 -20.08 25.71 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.229 -0.588 . . . . 0.0 110.503 172.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.429 ' SD ' HG12 ' A' 3563 ' ' VAL . 76.8 mtp -74.69 -21.5 59.36 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.739 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . 0.541 HG22 ' O ' ' A' 3565 ' ' ARG . 5.6 t -74.88 -7.32 53.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.113 0.483 . . . . 0.0 110.253 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.7 t -105.34 87.93 1.13 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.556 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.149 177.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -73.53 108.16 6.22 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.482 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.4 m 155.04 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.536 1.535 . . . . 0.0 107.811 -174.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -84.69 -24.96 28.73 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.934 -178.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.688 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -130.16 161.52 30.93 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.053 179.616 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.634 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 47.8 t -124.84 135.83 53.26 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 171.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.764 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.61 125.55 51.11 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.628 HD11 HD11 ' A' 3661 ' ' ILE . 76.8 mt -125.57 153.44 43.69 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.143 0.497 . . . . 0.0 110.951 -177.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.598 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -121.94 106.39 11.19 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.501 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.44 123.99 38.19 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.365 0.602 . . . . 0.0 110.24 -177.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.527 HD12 ' CE1' ' A' 3525 ' ' HIS . 79.1 mt -125.48 143.33 44.41 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.162 -178.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -61.36 113.33 1.73 Allowed 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.406 2.07 . . . . 0.0 111.637 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 28.0 p -100.89 111.69 23.96 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.096 0.474 . . . . 0.0 110.431 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . 0.461 ' H ' HG22 ' A' 3588 ' ' VAL . . . -104.07 146.08 16.23 Favored Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.727 177.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' 3583 ' ' ARG . 29.4 ttt180 -60.61 -35.82 77.07 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-O 121.344 0.592 . . . . 0.0 110.92 178.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.585 ' O ' HG23 ' A' 3588 ' ' VAL . 28.1 t70 -140.44 169.54 17.47 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -53.59 -39.85 65.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 118.003 0.365 . . . . 0.0 111.181 -178.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -63.39 -44.6 94.24 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.202 0.525 . . . . 0.0 110.603 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.451 ' HB3' ' H ' ' A' 3584 ' ' ASP . 12.6 t70 -63.34 -39.73 95.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.908 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' 3584 ' ' ASP . 84.9 t -60.08 -41.48 86.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.945 178.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 4.9 t -62.59 -50.34 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 CA-C-O 121.555 0.693 . . . . 0.0 109.744 -178.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 37.1 m -59.84 -41.76 92.11 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 114.391 -1.277 . . . . 0.0 111.555 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -68.63 -38.23 80.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.48 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . 0.437 ' O ' ' HG3' ' A' 3596 ' ' LYS . 86.6 m -58.55 -54.74 43.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.933 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -65.24 -33.4 75.9 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.965 -0.294 . . . . 0.0 111.2 -177.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 66.7 m -63.8 -45.94 87.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.421 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.568 HD12 ' HB2' ' A' 3599 ' ' PHE . 57.6 tp -62.95 -40.7 98.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.471 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.526 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 55.1 mtpt -58.74 -59.43 5.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.888 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.63 -29.53 69.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -174.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.64 -47.68 6.11 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -173.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.568 ' HB2' HD12 ' A' 3595 ' ' LEU . 23.5 m-85 -100.72 -50.26 3.92 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -174.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.526 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.4 mm -62.35 -58.59 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.893 -175.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 32.5 m -59.63 -31.61 69.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.237 -178.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.774 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -72.62 -58.61 3.23 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.812 177.752 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.774 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.37 -42.54 78.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.567 0.223 . . . . 0.0 111.56 -178.161 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -69.85 -38.15 76.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.6 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.22 -40.17 74.7 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.009 0.433 . . . . 0.0 110.499 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -73.98 -19.05 60.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.001 178.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . 0.496 ' O ' ' HG ' ' A' 3555 ' ' LEU . 23.5 mt-30 48.72 52.46 13.93 Favored 'General case' 0 C--O 1.23 0.068 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 -169.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.516 ' O ' HD12 ' A' 3603 ' ' LEU . . . -130.96 -175.96 3.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.978 -0.556 . . . . 0.0 112.197 -173.055 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.75 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.92 117.47 27.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.306 175.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.39 103.73 0.79 Allowed Glycine 0 C--O 1.222 -0.653 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.338 178.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.699 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.4 mm -89.28 120.23 37.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.207 0.527 . . . . 0.0 111.377 -173.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.662 HD13 ' HB3' ' A' 3547 ' ' LEU . 30.5 mt -122.53 105.29 15.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.825 175.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.529 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.8 m120 -83.65 125.06 31.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.866 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 34.5 m . . . . . 0 C--N 1.32 -0.702 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.443 178.929 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.529 ' O ' ' HA ' ' A' 3613 ' ' ASN . 79.3 m-85 . . . . . 0 CA--C 1.51 -0.59 0 CA-C-O 120.829 0.347 . . . . 0.0 110.492 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.517 HG13 HG23 ' A' 3611 ' ' ILE . 9.9 t -122.74 115.75 46.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.237 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.663 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -95.55 110.03 22.17 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 170.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.495 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 61.5 mt-30 -94.5 110.74 22.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.692 -177.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.595 HG12 HG12 ' A' 3659 ' ' ILE . 31.6 mt -89.75 98.27 7.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.126 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -87.54 144.5 35.61 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.875 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.647 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 58.8 Cg_endo -71.7 170.18 19.3 Favored 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.576 2.184 . . . . 0.0 111.404 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . 0.4 ' HD3' ' O ' ' A' 3656 ' ' HIS . 36.9 Cg_endo -67.96 77.61 0.59 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.362 2.041 . . . . 0.0 110.969 174.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . 0.549 ' O ' ' HG2' ' A' 3636 ' ' GLU . 8.4 p -111.95 162.77 14.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.297 -171.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -48.84 -39.28 24.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.993 176.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 46.6 t80 -58.18 -55.95 28.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.231 176.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 33.8 p -66.23 -54.16 28.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.481 -174.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.8 mm-40 -61.32 -35.15 76.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.795 -171.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 45.8 m -71.87 -46.0 59.38 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.058 0.456 . . . . 0.0 110.554 -178.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -63.32 -35.67 81.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.148 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.46 -32.9 74.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.031 176.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 1.088 ' HA ' HD22 ' A' 3647 ' ' LEU . 17.5 t -65.32 -35.76 81.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 0.0 110.08 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.97 -54.71 5.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.012 177.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.764 HD13 HD22 ' A' 3575 ' ' LEU . 28.2 mt -67.23 -39.62 86.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.463 -0.789 . . . . 0.0 112.821 -171.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.419 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -147.61 75.24 11.24 Favored Pre-proline 0 C--N 1.327 -0.385 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . 0.524 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 48.9 Cg_endo -69.52 -19.9 36.65 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.412 2.075 . . . . 0.0 111.752 178.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . 0.491 ' OD2' ' HG3' ' A' 3504 ' ' LYS . 43.6 m-20 -70.68 -51.66 26.22 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.026 -177.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.598 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -79.52 -28.01 41.35 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 1.088 HD22 ' HA ' ' A' 3640 ' ' SER . 25.4 tp -52.06 -48.47 64.61 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.618 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.88 -20.33 63.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.492 -176.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 8.3 t -89.58 -33.56 16.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.175 178.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.606 ' HA ' HG22 ' A' 3653 ' ' ILE . 6.3 pt -80.81 -16.78 12.44 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.849 179.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 6.1 t -59.88 -21.14 60.62 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.41 0.624 . . . . 0.0 109.685 174.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -88.14 -39.21 14.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.353 174.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.606 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -105.22 43.15 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 122.461 1.124 . . . . 0.0 109.439 -179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.471 ' N ' ' HD2' ' A' 3655 ' ' PRO . 20.3 m -37.19 -42.97 1.06 Allowed Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 113.98 -1.464 . . . . 0.0 113.524 172.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.52 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.8 Cg_endo -60.22 82.43 0.07 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.432 1.421 . . . . 0.0 111.661 168.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . 0.414 ' HB2' HD23 ' A' 3579 ' ' LEU . 25.7 p80 -148.18 174.64 11.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.145 -177.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.448 HD22 HG22 ' A' 3628 ' ' ILE . 39.1 mt -120.96 150.34 41.26 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.446 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 59.2 ttp -111.82 109.65 19.59 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 173.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.866 HD12 HD21 ' A' 3524 ' ' LEU . 83.5 mt -101.31 114.76 41.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 121.248 0.547 . . . . 0.0 111.19 -173.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.688 HG13 ' HD2' ' A' 3573 ' ' TYR . 72.4 t -101.1 114.54 40.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.799 -177.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.663 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.0 mt -90.51 112.09 24.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -117.12 129.21 55.82 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 120.882 0.372 . . . . 0.0 111.621 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 27.9 m -103.02 108.45 19.63 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 169.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.328 179.36 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.574 ' CD1' ' HB2' ' A' 3553 ' ' MET . 31.0 m-85 . . . . . 0 N--CA 1.482 1.134 0 CA-C-O 119.745 -0.169 . . . . 0.0 111.408 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.534 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.5 OUTLIER 53.49 -155.54 0.21 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.761 0.791 . . . . 0.0 111.419 179.143 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.465 ' H ' ' HB3' ' B' 2519 ' ' GLU . 98.5 m -153.14 123.22 6.98 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.577 -1.192 . . . . 0.0 107.996 167.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.573 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.343 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -177.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.573 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp . . . . . 0 CA--C 1.53 0.183 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.646 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -69.82 -15.81 63.17 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.557 0.617 . . . . 0.0 110.243 -172.363 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.602 ' N ' HD13 ' A' 3502 ' ' LEU . 28.2 mtpp -68.21 -24.73 64.97 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.2 175.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.426 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 28.4 mmtp -101.59 -42.56 6.18 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.232 176.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.744 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -144.3 99.35 4.96 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-O 121.503 0.668 . . . . 0.0 110.533 179.414 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . 0.646 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 92.6 Cg_endo -83.52 173.04 9.88 Favored 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 124.128 3.219 . . . . 0.0 113.958 -174.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.497 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 82.0 mt -73.64 138.6 20.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.394 -177.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 23.1 m -108.58 -31.42 2.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.217 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.818 ' CD1' HD12 ' A' 3524 ' ' LEU . 2.2 t-105 -138.75 148.84 44.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.391 -177.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -146.59 119.2 8.53 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 170.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . 0.471 ' O ' ' HA ' ' A' 3521 ' ' ALA . . . 177.97 -129.81 1.49 Allowed Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -175.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.604 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 4.9 mp -139.76 153.6 47.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.504 0.652 . . . . 0.0 111.931 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.466 HD23 ' HB2' ' A' 3547 ' ' LEU . 69.1 mt -106.15 154.12 21.13 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 167.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.673 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -142.83 121.86 12.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 117.97 0.35 . . . . 0.0 111.829 -177.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.758 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.34 147.09 41.08 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 172.797 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.758 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.8 OUTLIER 63.57 -99.25 0.07 Allowed 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -170.11 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -139.39 5.79 2.28 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.694 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 1.6 t0 -103.23 139.05 39.2 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.815 -172.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' 3514 ' ' ALA . 14.7 p -122.65 127.94 49.98 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.896 -177.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -115.74 115.51 26.46 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.602 177.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.604 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.01 112.67 6.57 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 121.299 0.571 . . . . 0.0 109.634 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.418 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 30.9 m -127.36 147.64 32.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.678 -176.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . 0.429 ' HG3' ' CE1' ' A' 3525 ' ' HIS . 20.2 pt20 -107.48 124.3 49.68 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.018 173.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.845 HD21 HD12 ' A' 3659 ' ' ILE . 4.8 mt -94.52 113.14 24.94 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.626 -176.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.497 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 56.5 m80 -91.03 142.6 27.6 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.688 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.744 ' O ' ' HB2' ' A' 3505 ' ' TYR . 60.0 t80 -70.02 137.31 51.24 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 172.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.571 ' CG1' HD23 ' A' 3575 ' ' LEU . 22.1 t -115.31 -55.8 4.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-O 121.383 0.611 . . . . 0.0 110.86 176.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.497 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 69.7 m -161.41 172.43 16.52 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.138 -171.253 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 84.51 -153.13 28.46 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.512 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.545 ' HB2' ' HA ' ' A' 3571 ' ' THR . 31.1 t30 -99.46 111.23 23.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.579 0.228 . . . . 0.0 111.102 -177.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -61.83 -29.02 69.89 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.313 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 98.7 t -58.79 -34.23 51.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.545 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.548 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 57.1 mt -59.3 -42.4 91.23 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.111 178.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.52 89.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.916 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -59.1 -38.72 80.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.166 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 9.0 ptm85 -88.5 -18.61 27.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -176.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.512 ' HB2' HD11 ' A' 3626 ' ' LEU . 43.9 p -92.27 -40.24 11.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.911 0.386 . . . . 0.0 111.193 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.629 HD13 ' HB2' ' A' 3509 ' ' TRP . 34.3 mt -79.39 120.98 82.29 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-O 121.108 0.48 . . . . 0.0 110.024 -174.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo . . . . . 0 CA--C 1.53 0.323 0 C-N-CA 123.429 2.752 . . . . 0.0 112.503 -177.116 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 36.5 Cg_exo . . . . . 0 C--O 1.233 0.272 0 N-CA-C 111.276 -0.317 . . . . 0.0 111.276 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.66 ' HB3' HD13 ' A' 3612 ' ' ILE . 36.9 mt -68.24 108.49 3.2 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' A' 3514 ' ' ALA . 19.3 ptt180 -97.41 138.48 34.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.056 0.455 . . . . 0.0 111.301 -175.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.465 HD12 HD22 ' A' 3515 ' ' LEU . 18.9 mt -91.15 106.68 17.82 Favored 'Isoleucine or valine' 0 C--O 1.247 0.938 0 CA-C-O 122.068 0.937 . . . . 0.0 111.105 -175.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.516 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.5 -1.45 14.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.81 -173.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.688 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 39.9 mt-30 -148.1 173.21 13.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.41 0.148 . . . . 0.0 110.863 177.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.608 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -150.91 140.91 22.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.004 0.431 . . . . 0.0 111.402 -179.686 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.669 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 21.7 ttt -109.53 124.93 51.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.089 178.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . 0.415 ' HG2' ' H ' ' A' 3554 ' ' ARG . 14.3 mmt180 -64.58 110.04 2.19 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.557 ' O ' HD12 ' A' 3555 ' ' LEU . 3.6 pp -79.24 97.57 6.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 118.559 -1.256 . . . . 0.0 108.605 176.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.552 ' O ' ' HG ' ' A' 3560 ' ' LEU . 44.9 mt-10 -118.07 164.03 15.73 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.471 -1.24 . . . . 0.0 109.225 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.484 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -49.99 -53.69 24.95 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.394 0.434 . . . . 0.0 111.52 -178.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 23.5 p -64.51 -39.81 94.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.482 -178.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.559 ' O ' HG23 ' A' 3563 ' ' VAL . 15.0 mm100 -66.75 -40.19 88.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.973 -179.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' 3556 ' ' GLU . 92.1 mt -61.19 -34.54 75.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.816 179.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.56 ' O ' ' HD3' ' A' 3565 ' ' ARG . 7.9 mm-40 -60.19 -49.67 76.69 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 174.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.58 -41.42 99.57 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.702 178.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' 3559 ' ' GLN . 57.7 t -60.43 -44.77 96.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.731 0.301 . . . . 0.0 110.28 177.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -57.2 -36.82 71.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.394 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.56 ' HD3' ' O ' ' A' 3561 ' ' GLU . 10.5 mpt_? -58.31 -45.15 88.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.735 -0.211 . . . . 0.0 111.506 179.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' 3563 ' ' VAL . 18.8 ptp180 -78.77 -16.34 57.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.861 0.362 . . . . 0.0 110.452 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.446 ' HG3' ' O ' ' A' 3563 ' ' VAL . 80.8 mtp -85.45 -22.01 28.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.575 0.702 . . . . 0.0 109.92 176.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 1.4 m -74.82 -23.46 58.47 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.26 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 39.7 t -98.01 87.76 1.64 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.358 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -74.23 107.72 6.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.545 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.6 m 150.57 -44.76 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.436 1.494 . . . . 0.0 107.769 -172.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.61 -31.1 24.45 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.832 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.861 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -119.62 158.93 25.39 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.213 0.53 . . . . 0.0 109.777 177.395 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.602 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 42.2 t -122.4 136.87 54.98 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 170.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.771 HD22 HD13 ' A' 3642 ' ' LEU . 14.2 tp -104.81 125.69 51.12 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.678 HD11 HD11 ' A' 3661 ' ' ILE . 70.6 mt -126.35 154.7 43.16 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.546 -177.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.692 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -122.08 107.03 11.72 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.099 179.697 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.517 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.14 120.25 34.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.489 0.662 . . . . 0.0 110.356 -178.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.547 ' HG ' HD12 ' A' 3577 ' ' LEU . 57.8 mt -122.18 146.34 46.49 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.791 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.23 116.9 3.56 Favored 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.145 1.897 . . . . 0.0 111.551 176.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 30.3 p -104.43 117.07 33.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.117 0.484 . . . . 0.0 109.97 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . 0.478 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.42 138.59 14.08 Favored Glycine 0 N--CA 1.437 -1.271 0 C-N-CA 120.262 -0.971 . . . . 0.0 111.82 178.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . 0.488 ' HG3' ' OD2' ' A' 3587 ' ' ASP . 33.0 mtt85 -70.24 -30.46 67.53 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.706 0.765 . . . . 0.0 109.093 177.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.505 ' O ' HG23 ' A' 3588 ' ' VAL . 3.9 p30 -140.04 174.57 10.39 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.956 178.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -60.47 -40.73 92.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.825 0.345 . . . . 0.0 111.115 -175.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . 0.412 ' HB3' ' OD1' ' A' 3584 ' ' ASP . 35.0 tt0 -67.19 -44.41 79.7 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.057 0.456 . . . . 0.0 109.922 178.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.488 ' OD2' ' HG3' ' A' 3583 ' ' ARG . 5.5 t70 -55.98 -45.68 78.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.58 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' 3584 ' ' ASP . 74.1 t -55.26 -54.7 22.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.828 178.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 82.1 t -58.4 -46.75 89.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.353 -178.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 46.9 t -60.54 -49.8 76.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.198 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -67.36 -30.34 70.11 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -177.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 83.2 m -61.92 -48.21 81.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.998 0.428 . . . . 0.0 110.026 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.9 -46.31 71.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.25 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 19.3 m -55.45 -47.51 75.93 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.517 178.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.608 HD12 ' HB2' ' A' 3599 ' ' PHE . 65.3 tp -63.57 -41.91 98.35 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.01 0.433 . . . . 0.0 110.332 176.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.593 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 1.9 ttmt -61.18 -50.12 74.45 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.011 -179.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . 0.419 ' N ' ' HG2' ' A' 3596 ' ' LYS . . . -73.66 -35.78 65.27 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -179.266 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.534 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -90.49 -46.35 8.38 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -171.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.633 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 11.6 m-85 -99.58 -50.0 4.22 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.822 0.344 . . . . 0.0 111.387 -175.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 28.5 mm -62.12 -58.69 6.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.735 -176.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 59.2 m -57.75 -38.54 75.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.247 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.694 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -67.72 -53.13 29.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.749 0.309 . . . . 0.0 110.627 179.277 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.694 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -69.21 -34.53 75.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.148 -170.225 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -70.58 -36.82 73.78 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.45 -37.71 74.36 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.816 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' A' 3602 ' ' TYR . 72.4 mmtt -73.56 -19.51 60.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.703 178.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . 0.447 ' O ' ' HG ' ' A' 3555 ' ' LEU . 74.6 mt-30 48.95 50.68 17.39 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -169.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -132.92 170.67 15.0 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.245 -172.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.669 ' HB3' ' HB3' ' A' 3553 ' ' MET . . . -105.27 118.15 35.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.258 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.68 105.89 1.3 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.336 177.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.688 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 34.4 mm -90.02 122.1 41.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-O 121.22 0.533 . . . . 0.0 111.181 -174.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.66 HD13 ' HB3' ' A' 3547 ' ' LEU . 32.4 mt -120.84 117.08 51.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.702 175.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 14.9 m120 -95.42 126.01 40.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.356 -176.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 32.1 m . . . . . 0 C--N 1.32 -0.681 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.351 177.927 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . . . . . . . . . 57.5 m-85 . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 121.136 0.493 . . . . 0.0 110.131 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.519 HG12 ' HG3' ' A' 3627 ' ' GLN . 2.8 t -124.23 118.01 52.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.059 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -96.28 111.3 23.41 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 171.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.53 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 76.2 mt-30 -94.18 110.94 22.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.953 -178.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.592 HG12 HG12 ' A' 3659 ' ' ILE . 26.3 mt -92.94 99.46 9.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.356 -179.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -89.01 138.08 29.34 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.001 178.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.631 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 45.0 Cg_endo -68.05 168.83 17.91 Favored 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.639 2.226 . . . . 0.0 111.186 176.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -65.36 81.43 0.22 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.469 2.113 . . . . 0.0 111.673 177.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . 0.542 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.9 p -113.24 162.6 15.82 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.523 -176.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -54.89 -35.81 64.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.832 0.349 . . . . 0.0 110.323 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 40.0 t80 -53.96 -53.59 50.77 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.114 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . 0.423 ' O ' ' HG ' ' A' 3639 ' ' LEU . 49.9 p -69.92 -53.65 16.95 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.873 -177.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' 3632 ' ' CYS . 20.6 mm-40 -61.12 -43.86 98.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.857 -172.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 41.6 t -66.56 -43.49 84.88 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.118 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 12.6 m80 -64.0 -36.22 83.27 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.544 176.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' 3635 ' ' SER . 79.0 mt -64.93 -42.37 94.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.959 177.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.779 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 36.6 t -58.41 -35.13 71.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.267 0.556 . . . . 0.0 110.448 178.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -79.83 -50.24 10.8 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.823 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.771 HD13 HD22 ' A' 3575 ' ' LEU . 19.7 mt -75.31 -38.3 60.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.46 -171.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.467 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -146.54 87.56 6.4 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.806 0.336 . . . . 0.0 111.332 -179.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.66 -24.98 21.19 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.587 2.191 . . . . 0.0 113.712 -174.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 4.1 t70 -80.31 -40.28 27.1 Favored 'General case' 0 CA--C 1.513 -0.444 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.534 -171.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.692 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.82 -29.4 44.75 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 176.559 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.779 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.26 -44.64 71.99 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.046 176.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -59.37 -34.58 72.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.903 0.382 . . . . 0.0 111.067 -179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 18.9 m -71.15 -41.8 69.96 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.916 0.389 . . . . 0.0 110.684 177.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.579 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.2 pt -79.59 -17.58 12.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.514 -173.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 48.8 m -57.74 -26.14 61.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.148 0.499 . . . . 0.0 110.441 174.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -87.4 -37.39 17.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.141 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.579 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.2 tp -104.91 43.64 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 122.406 1.098 . . . . 0.0 109.198 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.476 ' N ' ' HD2' ' A' 3655 ' ' PRO . 7.7 t -37.63 -43.46 1.41 Allowed Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 114.003 -1.453 . . . . 0.0 113.22 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.532 ' HG2' HD12 ' A' 3653 ' ' ILE . 15.3 Cg_endo -59.16 87.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 121.437 1.425 . . . . 0.0 111.601 169.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -154.83 177.95 10.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.399 -177.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.5 ' HB3' HG23 ' A' 3628 ' ' ILE . 43.5 mt -126.78 133.47 50.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.658 -179.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.7 tmm? -99.69 112.56 24.79 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.845 HD12 HD21 ' A' 3524 ' ' LEU . 75.8 mt -108.93 120.86 61.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 121.331 0.586 . . . . 0.0 111.838 -170.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.861 HG13 ' HD2' ' A' 3573 ' ' TYR . 63.7 t -103.65 116.64 47.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.779 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.678 HD11 HD11 ' A' 3576 ' ' LEU . 57.8 mt -90.69 111.78 24.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 176.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.51 128.68 56.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.781 0.324 . . . . 0.0 111.404 -176.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 14.8 m -77.66 119.82 21.74 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.885 173.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 52.6 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.677 -0.677 . . . . 0.0 109.713 177.72 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.473 ' CD2' ' HB2' ' A' 3553 ' ' MET . 42.4 m-85 . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 111.347 0.129 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.987 ' HG3' ' H ' ' B' 2520 ' ' THR . 6.7 tp10 58.0 -150.79 0.43 Allowed 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 177.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.987 ' H ' ' HG3' ' B' 2519 ' ' GLU . 33.7 m -154.98 126.59 7.44 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 174.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.555 HD13 ' HD2' ' A' 3552 ' ' ARG . 36.2 tp . . . . . 0 CA--C 1.515 -0.385 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.709 176.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.571 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp . . . . . 0 CA--C 1.532 0.277 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.626 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.38 -15.61 63.78 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.682 -173.929 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.626 ' N ' HD13 ' A' 3502 ' ' LEU . 23.3 ttmm -61.46 -38.42 87.17 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.063 0.459 . . . . 0.0 110.14 176.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.558 ' HD2' ' CD2' ' A' 3505 ' ' TYR . 7.5 tmtt? -94.66 -41.96 9.02 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.744 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -144.4 100.89 4.77 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.375 -177.111 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -87.61 173.43 5.33 Favored 'Trans proline' 0 CA--C 1.531 0.356 0 C-N-CA 124.257 3.304 . . . . 0.0 113.364 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.509 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 85.9 mt -71.6 128.96 35.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.719 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.472 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.0 m -98.48 -29.69 3.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.36 -178.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.571 ' CB ' HD13 ' A' 3538 ' ' LEU . 6.4 t-105 -153.57 158.16 40.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.21 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 25.1 tt0 -150.45 119.76 6.84 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 177.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.16 -132.56 1.41 Allowed Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.758 -0.734 . . . . 0.0 111.276 -176.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.635 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -139.85 153.21 46.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.056 0.455 . . . . 0.0 111.063 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.484 HD23 ' HB2' ' A' 3547 ' ' LEU . 73.7 mt -110.58 150.53 28.81 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 171.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.681 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.3 125.42 15.4 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -177.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.577 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.67 143.98 39.42 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 171.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.577 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.2 OUTLIER 62.29 -94.94 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 -168.784 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 13.4 m120 -142.66 5.74 1.6 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.727 174.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.411 ' O ' ' HA ' ' A' 3514 ' ' ALA . 26.4 m-20 -92.96 136.18 33.49 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.964 0.412 . . . . 0.0 110.727 -175.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.525 HG22 ' HB2' ' A' 3514 ' ' ALA . 13.4 p -123.98 140.69 52.73 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.219 -177.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.41 115.65 14.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.12 176.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.635 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -69.7 118.63 12.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.212 0.529 . . . . 0.0 109.857 175.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 27.3 m -131.07 147.55 33.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.82 -176.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -105.59 125.74 51.34 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.036 173.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.833 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -95.24 108.17 20.31 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.805 -175.797 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.509 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 71.4 m-70 -83.75 140.97 31.76 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.678 174.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.744 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.4 t80 -68.6 140.58 55.56 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 172.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.575 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.5 t -116.15 -53.06 4.58 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.373 0.606 . . . . 0.0 110.903 175.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.453 ' OG ' HD22 ' A' 3642 ' ' LEU . 39.4 t -162.38 170.81 18.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.268 -171.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.54 -147.83 20.19 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.885 176.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.544 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.8 t-20 -107.99 114.66 28.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.853 0.358 . . . . 0.0 110.845 -177.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -62.17 -32.37 72.98 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.811 -177.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . 0.518 ' O ' ' HG2' ' A' 3536 ' ' ARG . 45.4 t -60.06 -35.6 62.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.148 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.494 HD23 ' HD3' ' A' 3536 ' ' ARG . 16.9 mt -55.6 -40.24 71.79 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.404 177.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.503 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.31 -44.57 83.08 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.452 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 5.2 t60 -63.82 -32.49 74.02 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.049 -178.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.518 ' HG2' ' O ' ' A' 3532 ' ' VAL . 10.8 ptm180 -88.62 -11.69 44.73 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.491 ' HB2' HD11 ' A' 3626 ' ' LEU . 34.2 p -103.92 -40.37 6.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 111.396 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.571 HD13 ' CB ' ' A' 3509 ' ' TRP . 16.7 mt -80.2 114.42 46.76 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -176.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo . . . . . 0 N--CA 1.457 -0.622 0 C-N-CA 122.174 1.916 . . . . 0.0 111.871 -179.316 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . 0.516 ' HA ' ' O ' ' A' 3512 ' ' LEU . 6.3 Cg_exo . . . . . 0 N--CA 1.457 -0.67 0 CA-C-O 121.005 0.336 . . . . 0.0 112.318 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.671 ' HB3' HD13 ' A' 3612 ' ' ILE . 42.7 mt -69.32 110.93 4.9 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.015 176.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.681 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -96.97 138.37 34.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.116 0.484 . . . . 0.0 111.103 -177.541 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.5 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.3 mt -87.93 112.38 23.5 Favored 'Isoleucine or valine' 0 C--O 1.242 0.666 0 CA-C-O 121.872 0.844 . . . . 0.0 111.422 -173.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.592 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -121.47 4.9 10.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.786 -174.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.714 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 48.8 mt-30 -152.23 173.06 15.46 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.63 177.081 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.743 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.47 139.41 11.76 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.855 0.359 . . . . 0.0 111.654 -179.478 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.594 ' HB2' ' CD2' ' B' 2518 ' ' TYR . 13.7 tmm? -111.92 120.11 40.79 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.076 176.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -68.55 110.01 4.01 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.596 ' O ' HD12 ' A' 3555 ' ' LEU . 2.5 pp -69.77 98.38 1.2 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 122.241 1.02 . . . . 0.0 110.006 -175.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.614 ' O ' ' HG ' ' A' 3560 ' ' LEU . 38.1 mm-40 -116.83 159.16 22.78 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.535 179.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.509 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -50.19 -50.13 50.29 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.321 0.388 . . . . 0.0 111.392 -177.149 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 5.9 p -63.28 -43.91 96.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.646 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.481 ' O ' HG23 ' A' 3563 ' ' VAL . 16.9 mm-40 -66.28 -38.97 89.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.302 -178.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' 3556 ' ' GLU . 87.4 mt -61.95 -35.02 77.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.568 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' 3557 ' ' ALA . 76.1 mm-40 -60.91 -47.17 87.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.951 174.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -59.49 -35.74 86.61 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.637 176.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.523 ' O ' ' HG3' ' A' 3567 ' ' MET . 60.2 t -67.5 -53.66 30.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.828 0.347 . . . . 0.0 110.208 176.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . 0.486 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.1 -26.58 66.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.489 -178.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -58.33 -40.25 81.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' 3563 ' ' VAL . 12.0 ptp180 -88.38 -14.3 38.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.927 0.394 . . . . 0.0 110.791 177.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.523 ' HG3' ' O ' ' A' 3563 ' ' VAL . 88.1 mtp -79.03 -26.61 43.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.166 -178.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 8.5 t -74.99 -9.09 58.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.059 0.457 . . . . 0.0 110.644 -178.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 42.3 t -115.95 91.15 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.061 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -70.43 108.06 4.1 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 178.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.544 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.0 m 153.19 -46.22 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 O-C-N 125.046 1.466 . . . . 0.0 108.089 -173.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.31 -25.94 33.51 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.929 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.684 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -128.91 162.6 27.15 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.016 177.751 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.651 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 31.1 t -126.53 135.14 50.91 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.753 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.83 125.97 51.62 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.605 HD11 HD11 ' A' 3661 ' ' ILE . 67.7 mt -126.3 155.88 41.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.297 0.57 . . . . 0.0 111.035 -176.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.583 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -124.24 107.06 10.8 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.94 -179.689 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.472 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.64 119.74 33.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.379 0.609 . . . . 0.0 110.346 -177.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.445 ' HG ' HD12 ' A' 3577 ' ' LEU . 74.5 mt -119.44 143.78 35.23 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.238 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.93 112.8 1.4 Allowed 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 122.429 2.086 . . . . 0.0 111.641 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 28.5 p -101.93 113.49 26.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.196 0.522 . . . . 0.0 110.517 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.85 145.43 16.12 Favored Glycine 0 N--CA 1.438 -1.175 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.967 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . 0.473 ' HE ' ' CG ' ' A' 3587 ' ' ASP . 45.6 mtm180 -71.69 -34.46 69.67 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.697 0.76 . . . . 0.0 109.962 178.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.542 ' O ' HG23 ' A' 3588 ' ' VAL . 14.5 t70 -133.35 165.97 23.61 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.192 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . 0.416 ' O ' HG23 ' A' 3589 ' ' VAL . 36.2 tt0 -53.82 -37.46 63.59 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.069 0.461 . . . . 0.0 110.299 176.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -65.99 -44.8 83.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.279 176.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.504 ' HB3' ' H ' ' A' 3584 ' ' ASP . 14.8 t70 -64.46 -41.02 96.76 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.633 -177.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' 3584 ' ' ASP . 88.7 t -56.93 -48.0 82.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.321 178.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' 3585 ' ' GLN . 88.9 t -59.0 -47.34 90.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.391 178.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 22.4 t -62.53 -41.59 98.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.006 -179.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . 0.613 ' NE2' ' H ' ' A' 3521 ' ' ALA . 13.1 mm100 -67.95 -38.26 82.59 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 122.318 -0.239 . . . . 0.0 110.761 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . 0.528 HG22 ' HE2' ' A' 3596 ' ' LYS . 44.9 m -62.6 -52.24 64.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.702 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.6 pt-20 -62.71 -41.76 99.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.619 0.247 . . . . 0.0 111.146 -178.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.5 m -61.23 -46.64 89.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.852 0.358 . . . . 0.0 110.572 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.588 HD12 ' HB2' ' A' 3599 ' ' PHE . 50.3 tp -63.48 -42.55 98.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.762 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.562 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 57.7 mtmt -62.53 -45.53 92.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.506 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.03 -33.32 59.63 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.513 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -93.94 -46.65 7.07 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -172.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.724 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 21.4 m-85 -100.55 -50.93 3.74 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -176.214 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.562 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.0 mm -61.51 -60.9 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.276 -174.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 60.8 m -59.4 -40.59 87.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.3 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.724 ' HD2' ' HA ' ' A' 3599 ' ' PHE . 0.0 OUTLIER -65.04 -50.38 66.45 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.838 0.351 . . . . 0.0 110.835 -179.726 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.703 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -70.36 -36.05 73.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.911 -170.528 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -75.78 -29.17 58.68 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.942 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.31 -40.34 77.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.122 0.486 . . . . 0.0 110.175 176.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -73.46 -19.1 61.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.266 177.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . 0.446 ' O ' ' HG ' ' A' 3555 ' ' LEU . 46.4 mt-30 46.97 58.31 4.89 Favored 'General case' 0 C--O 1.232 0.161 0 O-C-N 123.815 0.697 . . . . 0.0 109.139 -168.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.425 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -140.88 174.59 10.37 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.38 0.61 . . . . 0.0 112.214 -172.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.743 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -108.28 117.54 34.43 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.453 174.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -65.34 103.73 0.85 Allowed Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 176.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.714 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 29.8 mm -89.32 123.37 41.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 121.374 0.607 . . . . 0.0 110.902 -174.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.671 HD13 ' HB3' ' A' 3547 ' ' LEU . 48.0 mt -120.82 111.92 33.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.179 174.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 6.6 m120 -88.84 136.18 33.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.872 -175.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.502 ' HB ' ' HB2' ' A' 3624 ' ' TYR . 46.1 t . . . . . 0 C--N 1.321 -0.636 0 CA-C-O 120.766 0.317 . . . . 0.0 110.193 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.502 ' HB2' ' HB ' ' A' 3614 ' ' VAL . 64.6 m-85 . . . . . 0 CA--C 1.517 -0.313 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.421 HG13 HD12 ' A' 3611 ' ' ILE . 2.9 t -130.68 116.65 35.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.79 175.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.6 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -100.84 113.79 27.04 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 170.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.528 ' O ' ' HA ' ' A' 3659 ' ' ILE . 78.5 mt-30 -94.41 111.09 22.83 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.715 -178.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.596 HG12 HG12 ' A' 3659 ' ' ILE . 44.9 mt -92.24 98.62 8.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-O 121.024 0.44 . . . . 0.0 110.181 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . 0.437 ' CE1' ' HB2' ' A' 3609 ' ' ALA . 84.1 m-85 -89.42 141.21 28.71 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.973 178.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.487 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 39.8 Cg_endo -67.05 172.93 9.14 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.583 2.188 . . . . 0.0 111.077 176.047 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -68.95 41.85 0.28 Allowed 'Trans proline' 0 CA--C 1.535 0.57 0 C-N-CA 122.739 2.293 . . . . 0.0 112.724 175.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . 0.502 ' O ' ' HG2' ' A' 3636 ' ' GLU . 27.0 p -77.4 162.1 27.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.726 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -54.9 -35.23 63.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.303 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 28.6 t80 -53.9 -52.33 60.87 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.004 0.43 . . . . 0.0 110.601 176.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 7.1 m -62.46 -56.64 16.25 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.654 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.5 mm-40 -58.3 -43.05 87.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.869 -172.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 35.6 p -62.8 -47.91 81.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.055 0.455 . . . . 0.0 110.754 -178.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 69.4 m80 -66.9 -34.76 78.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.436 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . 0.435 HD23 HG11 ' A' 3527 ' ' VAL . 82.1 mt -63.48 -32.85 74.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.841 175.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.688 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 19.3 m -69.44 -33.8 73.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.198 0.523 . . . . 0.0 110.399 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -84.13 -34.52 24.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.337 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.753 HD13 HD22 ' A' 3575 ' ' LEU . 19.3 mt -93.73 -24.56 17.78 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -172.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -154.54 75.0 5.83 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.628 0.251 . . . . 0.0 111.388 178.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.77 -24.9 61.24 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.599 2.199 . . . . 0.0 113.417 -175.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 10.0 t70 -75.78 -55.15 5.91 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.589 ' HB3' ' CE1' ' A' 3505 ' ' TYR . 0.1 OUTLIER -68.13 -30.57 69.75 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 179.858 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.688 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -53.96 -47.63 71.12 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.217 176.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -65.55 -19.07 65.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.874 0.368 . . . . 0.0 111.189 -178.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 70.8 m -87.74 -35.35 17.96 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.872 176.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.632 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.1 pt -79.94 -15.21 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.063 -178.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 49.0 m -61.92 -20.36 63.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.085 0.469 . . . . 0.0 110.181 175.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -88.31 -38.12 15.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.27 173.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.632 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -104.42 44.07 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 122.508 1.147 . . . . 0.0 108.853 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.467 ' N ' ' HD2' ' A' 3655 ' ' PRO . 16.1 m -32.62 -47.69 0.51 Allowed Pre-proline 0 N--CA 1.468 0.435 0 CA-C-N 113.624 -1.625 . . . . 0.0 113.174 171.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.497 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.7 Cg_endo -59.08 88.71 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.605 1.537 . . . . 0.0 111.9 170.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -154.66 169.64 23.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.369 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.458 ' HB3' HG23 ' A' 3628 ' ' ILE . 56.9 mt -121.88 133.71 54.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.371 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.7 tmm? -100.38 111.65 23.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.833 HD12 HD21 ' A' 3524 ' ' LEU . 75.9 mt -106.36 120.27 57.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.59 -170.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.684 HG13 ' HD2' ' A' 3573 ' ' TYR . 87.9 t -103.76 114.83 44.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.884 -178.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.651 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 69.7 mt -91.15 120.17 39.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.059 177.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -116.62 126.27 53.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.658 0.266 . . . . 0.0 110.763 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 23.4 p -96.91 122.85 40.34 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.282 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 33.8 t . . . . . 0 C--O 1.251 1.181 0 O-C-N 123.561 0.538 . . . . 0.0 110.983 178.531 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.594 ' CD2' ' HB2' ' A' 3553 ' ' MET . 7.2 m-85 . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 111.454 0.168 . . . . 0.0 111.454 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.847 ' HG2' ' H ' ' B' 2520 ' ' THR . 54.6 tt0 56.97 -150.11 0.45 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.847 ' H ' ' HG2' ' B' 2519 ' ' GLU . 5.9 t -167.32 132.34 1.99 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 175.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.736 HD12 HH11 ' A' 3552 ' ' ARG . 1.4 tp . . . . . 0 N--CA 1.449 -0.509 0 C-N-CA 120.415 -0.514 . . . . 0.0 110.019 179.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.552 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp . . . . . 0 N--CA 1.464 0.234 0 N-CA-C 113.33 0.863 . . . . 0.0 113.33 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.705 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -69.22 -15.31 63.35 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.501 -173.798 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.61 ' N ' HD13 ' A' 3502 ' ' LEU . 52.2 tptt -68.71 -24.0 64.43 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.541 176.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 60.6 mmtt -100.32 -43.03 6.4 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.037 174.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.708 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -149.16 104.07 3.34 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.637 -179.104 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . 0.705 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 84.5 Cg_endo -84.51 173.97 8.16 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 123.988 3.125 . . . . 0.0 113.938 -174.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.414 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 86.4 mt -71.83 133.42 31.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.915 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 26.9 m -100.94 -30.59 3.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.51 -178.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.636 ' CB ' HD13 ' A' 3538 ' ' LEU . 34.1 t-105 -150.23 149.72 30.57 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -143.77 119.35 10.4 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -174.48 -127.46 1.01 Allowed Glycine 0 N--CA 1.443 -0.853 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 -177.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.629 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -138.96 158.5 44.09 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.176 0.512 . . . . 0.0 111.124 177.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.494 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.7 mt -108.93 148.88 30.01 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 168.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.717 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -142.85 129.33 20.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.848 0.356 . . . . 0.0 111.182 -179.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.631 HD12 HD21 ' B' 2521 ' ' LEU . 0.2 OUTLIER -137.32 138.15 39.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 171.655 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.619 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.1 OUTLIER 63.94 -93.96 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -168.693 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 6.0 m120 -144.28 10.25 1.47 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.353 173.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.472 ' O ' ' HA ' ' A' 3514 ' ' ALA . 8.8 m-20 -86.72 132.98 33.71 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.218 -177.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . . . . . . . . . 24.7 p -122.5 129.86 52.43 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.324 0.583 . . . . 0.0 111.945 -175.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -130.71 115.03 16.12 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.075 173.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.629 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.74 125.11 25.93 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.478 HG21 ' HG ' ' A' 3513 ' ' LEU . 35.0 m -130.91 149.53 33.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.585 0.707 . . . . 0.0 111.972 -174.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -113.0 124.09 51.84 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.304 170.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.796 HD21 HD12 ' A' 3659 ' ' ILE . 0.8 OUTLIER -94.01 111.21 22.9 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.636 -174.319 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.424 ' CE1' HD12 ' A' 3579 ' ' LEU . 74.4 m80 -88.72 136.34 33.05 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.981 -1.008 . . . . 0.0 108.928 177.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.708 ' O ' ' HB2' ' A' 3505 ' ' TYR . 61.0 t80 -67.6 138.31 56.33 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.566 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.9 t -114.59 -56.67 4.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.243 0.544 . . . . 0.0 110.812 176.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.453 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 61.4 m -160.52 171.4 19.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.91 -171.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.19 -152.77 23.01 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.8 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.504 ' HB2' ' HA ' ' A' 3571 ' ' THR . 48.1 t-20 -91.97 111.3 22.78 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -177.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -64.26 -33.21 75.3 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.929 0.395 . . . . 0.0 110.788 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 60.6 t -62.52 -30.34 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.294 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.564 HD23 ' HD3' ' A' 3536 ' ' ARG . 15.8 mt -59.47 -41.42 89.72 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.354 178.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -68.96 -41.35 78.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.986 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 80.7 t60 -63.69 -33.64 76.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.111 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.564 ' HD3' HD23 ' A' 3533 ' ' LEU . 14.4 ptm180 -89.92 -11.73 40.94 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.47 ' O ' HG11 ' A' 3614 ' ' VAL . 47.5 p -103.7 -38.28 7.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.728 0.299 . . . . 0.0 111.522 -179.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.636 HD13 ' CB ' ' A' 3509 ' ' TRP . 20.3 mt -81.42 110.11 17.34 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.955 0.407 . . . . 0.0 110.005 -176.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . 0.417 ' HD3' ' O ' ' A' 3537 ' ' SER . 58.6 Cg_endo . . . . . 0 N--CA 1.46 -0.466 0 C-N-CA 122.936 2.424 . . . . 0.0 113.03 -175.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo . . . . . 0 C--O 1.236 0.408 0 CA-C-O 120.915 0.298 . . . . 0.0 112.68 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.718 ' HB3' HD13 ' A' 3612 ' ' ILE . 22.5 mt -67.7 113.91 5.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.63 179.12 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.717 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -96.62 138.16 34.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.133 0.492 . . . . 0.0 112.028 -172.061 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.412 ' HB ' ' HB2' ' A' 3515 ' ' LEU . 19.4 mt -95.98 107.57 19.89 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-O 122.236 1.017 . . . . 0.0 111.694 -172.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.439 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.93 -2.61 13.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.054 -173.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.665 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 69.4 mt-30 -146.81 176.72 9.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.359 0.123 . . . . 0.0 110.872 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.8 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.45 140.58 12.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.952 0.406 . . . . 0.0 111.604 179.285 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.585 ' HB2' ' CD2' ' B' 2518 ' ' TYR . 14.8 tmm? -109.71 122.8 48.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.174 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' 3554 ' ' ARG . 8.5 mmm180 -69.88 110.07 4.8 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 -177.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.517 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -73.52 98.3 2.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.281 1.039 . . . . 0.0 109.524 -177.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.616 ' O ' ' HG ' ' A' 3560 ' ' LEU . 34.2 mt-10 -111.49 171.67 7.34 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.67 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -57.54 -51.34 69.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.843 0.354 . . . . 0.0 111.041 -179.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 36.1 p -65.91 -32.81 74.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.387 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.583 ' O ' HG23 ' A' 3563 ' ' VAL . 18.9 mm-40 -71.53 -40.54 70.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.093 179.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' 3556 ' ' GLU . 84.8 mt -60.06 -34.27 73.2 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.019 0.437 . . . . 0.0 110.109 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' 3557 ' ' ALA . 17.5 mm-40 -60.9 -49.74 76.24 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.119 173.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -65.02 -30.2 77.37 Favored Glycine 0 CA--C 1.52 0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.771 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.596 ' O ' ' HG3' ' A' 3567 ' ' MET . 59.8 t -66.71 -53.87 30.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 174.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.22 -31.06 68.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.594 178.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -53.08 -51.82 60.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.691 176.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . 0.447 HH11 ' HD3' ' A' 3566 ' ' ARG . 14.0 ptt-85 -83.04 -9.28 59.33 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.093 0.473 . . . . 0.0 111.046 -178.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.596 ' HG3' ' O ' ' A' 3563 ' ' VAL . 81.2 mtp -84.5 -22.72 30.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.812 178.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . . . . . . . . . 43.5 p -77.42 -5.73 50.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.035 0.445 . . . . 0.0 110.988 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 20.5 t -119.34 78.7 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.798 175.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.0 108.85 1.93 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.66 176.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.504 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 1.8 m 153.05 -41.73 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 O-C-N 124.921 1.388 . . . . 0.0 108.346 -176.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -84.96 -26.23 27.3 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.641 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.685 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -124.93 164.81 19.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.757 177.834 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.673 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 33.7 t -127.49 136.61 52.0 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 172.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.715 HD22 HD13 ' A' 3642 ' ' LEU . 13.0 tp -105.73 125.12 50.61 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.647 HD11 HD11 ' A' 3661 ' ' ILE . 67.7 mt -126.85 155.24 43.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.115 0.483 . . . . 0.0 111.035 -177.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.71 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -123.79 107.19 11.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.203 179.257 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.474 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.35 122.61 37.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.527 0.679 . . . . 0.0 110.488 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.504 HD21 HG22 ' A' 3650 ' ' ILE . 68.8 mt -122.88 147.58 51.53 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.658 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . 0.466 ' HA ' ' O ' ' A' 3521 ' ' ALA . 13.8 Cg_endo -57.42 125.47 18.93 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 122.096 1.864 . . . . 0.0 111.829 176.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 29.8 p -107.61 119.19 38.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.308 0.575 . . . . 0.0 110.164 178.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.49 146.08 16.13 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.769 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . 0.432 ' HG3' ' OD2' ' A' 3587 ' ' ASP . 35.6 mtp180 -69.97 -20.53 63.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.7 0.762 . . . . 0.0 108.946 173.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.599 ' O ' HG23 ' A' 3588 ' ' VAL . 9.7 t70 -154.26 169.55 23.39 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.553 -1.203 . . . . 0.0 107.876 -178.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -56.69 -44.69 81.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 118.165 0.439 . . . . 0.0 110.905 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.72 -35.51 80.8 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.484 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.457 ' HB3' ' H ' ' A' 3584 ' ' ASP . 20.3 t70 -68.02 -40.72 82.9 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.194 -178.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' 3584 ' ' ASP . 73.9 t -56.12 -45.15 80.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.511 177.023 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 85.6 t -55.78 -46.96 80.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.786 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 28.7 t -65.28 -43.79 90.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.026 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -64.24 -37.28 86.91 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.49 179.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 90.1 m -60.95 -54.96 38.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.612 177.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -65.54 -36.0 82.52 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.276 -177.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 20.9 t -65.32 -44.42 87.86 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.511 HD12 ' HB2' ' A' 3599 ' ' PHE . 58.7 tp -64.66 -45.96 84.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.119 -178.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.795 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.62 -29.3 69.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.324 -176.42 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -85.6 -41.05 15.59 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.245 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -86.87 -46.36 9.99 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -171.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.511 ' HB2' HD12 ' A' 3595 ' ' LEU . 11.2 m-85 -98.91 -50.74 4.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.806 0.336 . . . . 0.0 111.212 -175.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.795 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 24.8 mm -59.8 -54.55 33.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.978 -176.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . 0.463 ' O ' ' HG3' ' A' 3604 ' ' GLN . 59.2 m -62.42 -38.4 89.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.431 -178.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 43.0 t80 -72.05 -54.32 10.2 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.116 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.532 HD12 ' O ' ' A' 3608 ' ' ALA . 0.4 OUTLIER -57.01 -38.78 73.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.794 179.85 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' 3601 ' ' THR . 0.0 OUTLIER -72.29 -34.64 68.32 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.149 -179.819 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -64.86 -36.98 86.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.874 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -84.1 -18.14 37.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.119 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 51.21 55.38 9.58 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -169.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.552 ' HB1' ' HB2' ' A' 3552 ' ' ARG . . . -135.21 -177.63 4.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.256 0.551 . . . . 0.0 112.113 -173.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.8 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.65 117.46 28.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.672 175.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -62.81 104.48 0.8 Allowed Glycine 0 C--O 1.224 -0.517 0 C-N-CA 120.751 -0.738 . . . . 0.0 111.365 178.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.665 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.5 mm -89.86 124.01 42.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.322 0.582 . . . . 0.0 110.884 -174.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.718 HD13 ' HB3' ' A' 3547 ' ' LEU . 45.7 mt -119.78 108.66 24.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.607 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.412 ' HA ' ' O ' ' A' 3624 ' ' TYR . 87.2 m-20 -85.22 121.17 27.58 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.67 -176.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . 0.47 HG11 ' O ' ' A' 3537 ' ' SER . 48.4 t . . . . . 0 C--N 1.322 -0.591 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.983 -178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.461 ' HB2' ' HB ' ' A' 3614 ' ' VAL . 60.0 m-85 . . . . . 0 CA--C 1.512 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.487 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.497 HG13 HD12 ' A' 3611 ' ' ILE . 4.1 t -126.05 113.89 36.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.095 177.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.4 mp -98.84 112.46 24.55 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.479 ' O ' ' HA ' ' A' 3659 ' ' ILE . 33.9 mt-30 -95.14 111.15 23.01 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.9 -176.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.574 HG12 HG12 ' A' 3659 ' ' ILE . 39.9 mt -93.12 99.12 9.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.628 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -89.71 145.21 33.04 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.005 178.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.32 169.37 18.5 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.427 2.085 . . . . 0.0 111.243 173.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . 0.425 ' HD3' HD12 ' A' 3600 ' ' ILE . 57.0 Cg_endo -71.08 48.23 0.85 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.185 2.59 . . . . 0.0 112.576 178.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.9 p -74.72 163.4 27.73 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.374 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -47.43 -47.56 26.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.71 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 30.1 t80 -47.06 -48.11 22.52 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.414 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 20.6 t -59.26 -58.8 7.06 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.978 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -66.76 -35.22 79.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.336 -171.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 62.0 m -58.18 -57.77 11.39 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 120.867 0.365 . . . . 0.0 110.725 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . 0.491 ' CE1' HD11 ' A' 3575 ' ' LEU . 10.2 p80 -69.42 -26.14 64.47 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 120.145 -0.622 . . . . 0.0 110.721 -177.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 50.2 mt -64.42 -35.27 80.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.843 0.354 . . . . 0.0 110.375 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.948 ' HA ' HD22 ' A' 3647 ' ' LEU . 16.6 m -67.78 -39.01 84.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.232 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -78.18 -24.06 47.34 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.491 -177.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.715 HD13 HD22 ' A' 3575 ' ' LEU . 17.4 mt -101.13 -41.0 6.91 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -172.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.514 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -147.09 89.11 5.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.751 0.31 . . . . 0.0 111.687 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . 0.434 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 85.6 Cg_endo -78.14 -16.78 13.82 Favored 'Trans proline' 0 CA--C 1.534 0.475 0 C-N-CA 122.608 2.205 . . . . 0.0 113.974 -175.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 6.8 t0 -76.08 -53.4 8.39 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -177.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.71 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -73.13 -28.02 62.01 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 179.82 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.948 HD22 ' HA ' ' A' 3640 ' ' SER . 24.3 tp -52.15 -52.88 49.08 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.061 0.458 . . . . 0.0 111.04 175.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.23 -17.95 63.01 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.254 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 11.0 m -87.39 -37.34 17.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.474 178.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.602 ' HA ' HG22 ' A' 3653 ' ' ILE . 3.5 pt -79.4 -12.13 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.863 0.363 . . . . 0.0 111.392 -178.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 19.7 m -55.05 -37.97 67.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.485 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 8.8 t30 -80.16 -33.5 38.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.841 0.353 . . . . 0.0 110.743 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.602 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.6 tp -104.01 39.67 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 122.585 1.184 . . . . 0.0 109.279 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.439 ' N ' ' HD2' ' A' 3655 ' ' PRO . 47.0 t -33.92 -46.03 0.63 Allowed Pre-proline 0 CA--C 1.541 0.604 0 CA-C-N 113.582 -1.644 . . . . 0.0 113.286 169.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.463 ' HG2' HD12 ' A' 3653 ' ' ILE . 19.8 Cg_endo -61.17 79.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.519 1.479 . . . . 0.0 111.776 170.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . 0.404 ' HB2' HD23 ' A' 3579 ' ' LEU . 31.5 p80 -143.78 170.31 16.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.999 -178.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.471 HD22 HG22 ' A' 3628 ' ' ILE . 69.2 mt -115.38 143.38 45.37 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.526 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 8.7 tmm? -110.48 111.26 22.39 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 177.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.796 HD12 HD21 ' A' 3524 ' ' LEU . 70.3 mt -107.95 122.52 62.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.652 -170.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.685 HG13 ' HD2' ' A' 3573 ' ' TYR . 72.3 t -106.27 116.47 50.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.005 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.673 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 54.0 mt -91.0 113.12 26.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.81 128.92 56.26 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.107 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 13.7 m -76.14 132.12 39.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.955 174.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.441 -0.79 . . . . 0.0 109.696 175.677 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.585 ' CD2' ' HB2' ' A' 3553 ' ' MET . 13.2 m-85 . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 120.36 0.124 . . . . 0.0 111.238 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.682 ' HG2' ' H ' ' B' 2520 ' ' THR . 14.5 tt0 55.09 -157.28 0.22 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.682 ' H ' ' HG2' ' B' 2519 ' ' GLU . 85.3 m -155.53 121.26 5.01 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 174.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.71 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.411 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.713 -179.414 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.567 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp . . . . . 0 N--CA 1.455 -0.201 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.614 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.17 -15.68 62.98 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.239 -173.852 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.614 ' N ' HD13 ' A' 3502 ' ' LEU . 49.6 tptt -67.05 -30.58 70.69 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 177.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 17.1 tptm -96.37 -39.68 9.49 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.399 178.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.688 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -151.4 106.97 2.94 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 121.454 0.645 . . . . 0.0 111.148 178.756 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . 0.546 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 97.5 Cg_endo -86.35 174.41 6.05 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 124.184 3.256 . . . . 0.0 113.937 -177.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.507 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 94.4 mt -71.4 135.41 28.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.259 -178.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.521 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.4 m -102.46 -29.9 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.325 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.65 ' HB2' HD13 ' A' 3538 ' ' LEU . 39.9 t-105 -150.07 154.66 38.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.286 -178.32 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -150.52 119.14 6.51 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.3 -125.06 0.78 Allowed Glycine 0 N--CA 1.443 -0.881 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 -176.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.655 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.5 mp -141.44 158.57 43.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.087 0.47 . . . . 0.0 111.178 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.476 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 81.8 mt -113.24 150.25 32.64 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 169.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.591 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.21 125.62 13.97 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -177.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.596 HD12 HD21 ' B' 2521 ' ' LEU . 0.2 OUTLIER -138.39 138.71 38.5 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 171.944 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.553 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.3 OUTLIER 59.97 -96.31 0.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.537 0.523 . . . . 0.0 110.122 -170.644 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -138.06 9.33 2.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.579 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.41 ' O ' ' HA ' ' A' 3514 ' ' ALA . 27.5 m-20 -100.28 125.71 46.51 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.857 -177.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' 3514 ' ' ALA . 38.6 p -117.73 134.83 54.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.563 177.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -129.86 122.51 28.81 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.655 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.67 119.42 17.87 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.076 0.465 . . . . 0.0 110.133 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.428 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 35.0 m -130.44 147.98 33.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.596 0.712 . . . . 0.0 112.061 -175.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -108.89 126.02 52.62 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.043 172.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.825 HD21 HD12 ' A' 3659 ' ' ILE . 1.2 mt -94.83 110.31 22.19 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.736 -176.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.507 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 79.2 m-70 -86.71 138.96 31.21 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.03 -0.986 . . . . 0.0 108.878 176.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.688 ' O ' ' HB2' ' A' 3505 ' ' TYR . 69.1 t80 -68.99 137.91 54.1 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 173.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.584 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.3 t -114.61 -56.51 4.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 CA-C-O 121.474 0.654 . . . . 0.0 110.664 176.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.439 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 73.8 m -160.83 171.84 18.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.997 -172.081 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 90.12 -150.95 21.25 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.897 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.549 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.7 t-20 -101.53 111.73 24.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.955 0.407 . . . . 0.0 111.099 -177.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.2 p30 -62.31 -30.67 71.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.482 -177.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . 0.565 ' O ' ' HG2' ' A' 3536 ' ' ARG . 62.1 t -61.08 -35.57 66.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.491 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.434 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 29.7 mt -55.98 -40.45 73.31 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.929 177.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.405 ' HB1' ' CD1' ' A' 3538 ' ' LEU . . . -70.19 -37.14 75.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.994 0.426 . . . . 0.0 110.693 -179.504 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -61.5 -39.34 90.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.892 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.565 ' HG2' ' O ' ' A' 3532 ' ' VAL . 12.5 ptp180 -88.7 -21.39 23.91 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -177.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.527 ' HB2' HD11 ' A' 3626 ' ' LEU . 58.0 p -90.17 -43.31 10.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.71 0.291 . . . . 0.0 111.508 -178.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.65 HD13 ' HB2' ' A' 3509 ' ' TRP . 25.2 mt -78.65 113.59 36.14 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -174.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo . . . . . 0 N--CA 1.461 -0.392 0 C-N-CA 123.174 2.583 . . . . 0.0 113.258 -170.803 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . 0.638 ' HA ' ' O ' ' A' 3512 ' ' LEU . 93.2 Cg_endo . . . . . 0 N--CA 1.451 -0.974 0 CA-C-O 120.926 0.302 . . . . 0.0 112.232 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.676 ' HB3' HD13 ' A' 3612 ' ' ILE . 28.6 mt -69.24 113.22 6.39 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.795 175.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.591 ' HA ' ' O ' ' A' 3514 ' ' ALA . 40.4 ptt85 -91.41 135.76 33.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.936 0.398 . . . . 0.0 110.842 -175.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.677 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.2 mt -91.61 107.87 19.31 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-O 122.211 1.005 . . . . 0.0 111.021 -177.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.478 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -115.21 2.32 14.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.179 -0.918 . . . . 0.0 111.562 -175.012 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.698 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 73.9 mt-30 -151.54 171.94 16.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.581 0.229 . . . . 0.0 110.98 178.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.696 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.28 138.34 16.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.013 0.435 . . . . 0.0 111.322 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.718 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 17.9 ttt -109.49 124.88 51.81 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.467 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -65.75 110.79 2.94 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.37 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.57 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -75.13 97.95 3.58 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 122.32 1.057 . . . . 0.0 108.965 178.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.664 ' HB2' ' HG2' ' A' 3559 ' ' GLN . 58.2 mm-40 -113.18 165.43 12.41 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.821 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.498 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.31 -51.87 65.31 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.319 0.387 . . . . 0.0 111.098 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 41.5 p -62.09 -33.15 73.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.073 0.463 . . . . 0.0 110.908 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.664 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 32.1 mm-40 -73.88 -44.43 55.35 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.047 -176.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.542 HD21 ' HB2' ' A' 3555 ' ' LEU . 83.0 mt -64.11 -32.56 74.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.254 -176.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' 3557 ' ' ALA . 8.0 mm-40 -69.23 -44.02 72.84 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . 0.417 ' O ' ' HB3' ' A' 3565 ' ' ARG . . . -59.49 -40.03 95.7 Favored Glycine 0 CA--C 1.52 0.357 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.312 176.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' 3559 ' ' GLN . 62.7 t -62.51 -48.02 90.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 175.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . 0.538 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.44 -32.3 70.08 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.113 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.503 ' O ' HG22 ' A' 3568 ' ' THR . 43.4 ttm180 -57.82 -46.26 84.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.81 177.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -87.05 -5.32 59.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.936 0.398 . . . . 0.0 111.297 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.538 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 82.5 mtp -88.65 -21.12 24.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.959 176.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . 0.503 HG22 ' O ' ' A' 3565 ' ' ARG . 3.3 t -74.59 -14.34 60.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.84 0.352 . . . . 0.0 111.186 -174.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 99.2 t -114.4 101.98 13.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.113 0.482 . . . . 0.0 110.412 178.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -73.99 108.32 6.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.549 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.5 m 151.47 -39.96 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.45 1.5 . . . . 0.0 108.082 -174.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -82.46 -26.37 32.71 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.523 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.732 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -135.36 169.06 18.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.294 179.061 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.62 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 34.5 t -130.1 136.56 49.46 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 171.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.781 HD22 HD13 ' A' 3642 ' ' LEU . 13.1 tp -106.54 125.98 51.69 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.667 HD11 HD11 ' A' 3661 ' ' ILE . 79.5 mt -127.53 157.05 41.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.175 0.512 . . . . 0.0 111.022 -177.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.616 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -124.03 109.43 13.51 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.173 179.079 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.472 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -95.1 123.36 38.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.277 0.561 . . . . 0.0 110.584 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.452 ' HG ' HD12 ' A' 3577 ' ' LEU . 69.0 mt -124.02 144.83 46.25 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.09 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.83 112.51 1.66 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.402 2.068 . . . . 0.0 111.955 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.9 p -96.74 108.31 20.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.222 0.534 . . . . 0.0 110.657 -177.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.06 146.79 16.67 Favored Glycine 0 N--CA 1.442 -0.93 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.059 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . 0.402 ' HG2' ' H ' ' A' 3583 ' ' ARG . 13.5 mmt180 -68.31 -36.68 79.68 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.682 0.753 . . . . 0.0 109.46 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.639 ' O ' HG23 ' A' 3588 ' ' VAL . 17.1 t70 -129.72 164.71 23.4 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.311 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . 0.44 ' O ' HG23 ' A' 3589 ' ' VAL . 23.7 tp60 -56.61 -39.39 73.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.887 0.375 . . . . 0.0 110.374 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -64.58 -44.89 89.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.144 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.49 ' HB3' ' H ' ' A' 3584 ' ' ASP . 30.0 t70 -60.59 -43.16 97.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.308 178.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.639 HG23 ' O ' ' A' 3584 ' ' ASP . 98.4 t -56.04 -47.99 79.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.215 177.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' 3585 ' ' GLN . 80.4 t -60.06 -47.23 92.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.293 178.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 42.3 t -60.73 -42.06 96.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.061 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -69.55 -36.06 76.0 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.001 -0.279 . . . . 0.0 110.661 177.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 85.6 m -62.25 -53.17 58.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.697 178.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' 3596 ' ' LYS . 11.9 pt-20 -63.57 -34.15 77.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.18 -178.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.6 m -69.35 -46.12 67.77 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.884 0.374 . . . . 0.0 110.259 177.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.592 HD12 ' HB2' ' A' 3599 ' ' PHE . 63.9 tp -64.36 -43.55 94.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.958 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.811 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.1 OUTLIER -66.3 -32.87 74.54 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.958 -177.002 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.56 -37.58 22.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.795 0.331 . . . . 0.0 111.404 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.565 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -88.95 -45.91 9.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -172.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.72 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 19.7 m-85 -99.73 -50.08 4.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.671 0.272 . . . . 0.0 111.542 -176.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.811 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 24.0 mm -62.04 -60.28 2.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.131 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 91.2 m -56.96 -42.44 80.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.147 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.72 ' HD2' ' HA ' ' A' 3599 ' ' PHE . 0.0 OUTLIER -63.52 -53.37 52.99 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.542 0.211 . . . . 0.0 110.826 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.709 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -66.73 -36.22 81.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.916 0.389 . . . . 0.0 110.916 -170.916 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -73.87 -36.35 64.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.075 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -71.46 -34.56 70.32 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.786 0.327 . . . . 0.0 110.911 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . 0.586 ' HG2' ' O ' ' A' 3602 ' ' TYR . 66.5 mmtt -73.92 -18.17 60.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 177.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . 0.501 ' O ' ' HG ' ' A' 3555 ' ' LEU . 21.1 mt-30 55.05 43.61 29.44 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -172.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.578 ' HB1' ' HB2' ' A' 3552 ' ' ARG . . . -132.62 172.06 13.02 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.541 -170.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.718 ' HB3' ' HB3' ' A' 3553 ' ' MET . . . -107.95 118.67 37.35 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.354 172.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -63.01 103.6 0.67 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.211 177.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.698 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 32.7 mm -90.01 126.69 42.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 121.188 0.518 . . . . 0.0 110.924 -175.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.676 HD13 ' HB3' ' A' 3547 ' ' LEU . 39.7 mt -125.94 115.07 41.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.882 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . 0.435 ' HA ' ' O ' ' A' 3624 ' ' TYR . 6.9 m120 -90.09 119.75 30.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.0 179.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 30.2 m . . . . . 0 C--N 1.316 -0.859 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.863 -178.543 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . 0.512 ' OH ' ' HD3' ' A' 3536 ' ' ARG . 78.9 m-85 . . . . . 0 CA--C 1.511 -0.52 0 CA-C-O 121.031 0.443 . . . . 0.0 110.587 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.455 HG12 ' HG3' ' A' 3627 ' ' GLN . 5.7 t -119.37 114.7 45.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.99 178.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -96.27 110.93 23.15 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.478 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 18.3 mt-30 -94.44 110.43 22.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.826 -178.145 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.578 HG12 HG12 ' A' 3659 ' ' ILE . 35.6 mt -92.14 99.27 9.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.97 141.6 29.68 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.038 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.414 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 40.6 Cg_endo -67.33 165.39 27.07 Favored 'Trans proline' 0 CA--C 1.53 0.309 0 C-N-CA 122.591 2.194 . . . . 0.0 111.233 175.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -69.28 77.93 0.87 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.535 2.157 . . . . 0.0 111.876 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . 0.435 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.5 p -112.25 163.7 14.07 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.689 -174.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . 0.521 ' CD ' ' H ' ' A' 3633 ' ' GLU . 1.6 mp0 -46.47 -42.75 15.94 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.545 175.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 42.5 t80 -52.27 -52.12 54.55 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.451 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 55.1 p -69.69 -51.18 36.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.693 -177.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' 3632 ' ' CYS . 13.3 mm-40 -60.35 -44.1 95.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.781 0.324 . . . . 0.0 111.361 -175.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 37.9 t -63.32 -39.51 94.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.192 0.52 . . . . 0.0 110.456 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 32.3 m80 -73.84 -33.07 63.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.66 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 75.8 mt -68.33 -37.22 80.34 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.407 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.474 ' CA ' ' HG ' ' A' 3647 ' ' LEU . 21.3 p -72.08 -31.1 65.78 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.255 0.55 . . . . 0.0 110.318 176.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . 0.489 ' HA ' ' CZ ' ' A' 3641 ' ' ARG . 1.2 tpm_? -76.04 -30.7 58.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.035 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.781 HD13 HD22 ' A' 3575 ' ' LEU . 16.4 mt -103.71 -32.65 9.27 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -172.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.433 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -148.7 72.74 10.59 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -175.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . 0.462 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 37.1 Cg_endo -65.57 -22.17 58.69 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 122.494 2.13 . . . . 0.0 111.764 179.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . 0.415 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 12.1 m-20 -70.1 -45.92 65.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.901 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.616 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -84.95 -30.74 24.04 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.575 176.73 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.474 ' HG ' ' CA ' ' A' 3640 ' ' SER . 3.4 tm? -54.19 -48.65 70.73 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.968 -179.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.66 -18.44 59.54 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.845 0.355 . . . . 0.0 111.67 -176.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 6.4 t -89.73 -38.28 13.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.189 179.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.588 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.1 pt -76.59 -13.32 14.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -175.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.7 m -63.22 -17.65 62.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.953 0.406 . . . . 0.0 110.756 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 8.3 t30 -88.33 -36.71 16.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.171 0.51 . . . . 0.0 109.888 173.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.588 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -104.85 41.93 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-O 122.41 1.1 . . . . 0.0 109.327 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.449 ' N ' ' HD2' ' A' 3655 ' ' PRO . 66.5 m -33.47 -45.7 0.53 Allowed Pre-proline 0 CA--C 1.539 0.536 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.83 170.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.513 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.2 Cg_endo -59.4 84.42 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.511 1.474 . . . . 0.0 111.562 169.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -150.74 170.93 18.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.434 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.489 HD22 HG22 ' A' 3628 ' ' ILE . 43.8 mt -123.17 136.32 54.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.559 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 14.5 tmm? -102.7 111.81 24.3 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.825 HD12 HD21 ' A' 3524 ' ' LEU . 70.8 mt -107.31 119.74 57.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.276 0.56 . . . . 0.0 111.529 -170.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.732 HG13 ' HD2' ' A' 3573 ' ' TYR . 81.0 t -102.93 116.5 46.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.77 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.667 HD11 HD11 ' A' 3576 ' ' LEU . 55.1 mt -91.05 112.46 25.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 176.016 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -115.16 133.67 55.83 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.433 -177.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.9 m -67.82 110.05 3.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.7 171.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.25 1.084 0 C-N-CA 124.679 1.192 . . . . 0.0 112.75 -174.364 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.483 ' CD1' ' HB2' ' A' 3553 ' ' MET . 40.9 m-85 . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 119.833 -0.127 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.568 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.5 OUTLIER 54.54 -163.11 0.12 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.589 0.709 . . . . 0.0 111.948 178.237 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . . . . . . . . . 10.8 p -145.47 116.15 7.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.413 167.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.677 HD22 ' CG2' ' A' 3549 ' ' ILE . 3.1 tp . . . . . 0 CA--C 1.521 -0.167 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.254 -178.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3501 ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp . . . . . 0 CA--C 1.53 0.191 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3502 ' ' LEU . . . . . 0.587 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -68.94 -14.79 63.25 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.339 -174.567 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 3503 ' ' LYS . . . . . 0.587 ' N ' HD13 ' A' 3502 ' ' LEU . 12.2 tmtt? -66.6 -28.99 68.94 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 176.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -99.78 -42.88 6.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.356 177.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3505 ' ' TYR . . . . . 0.701 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.17 99.16 3.7 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 121.481 0.657 . . . . 0.0 110.781 -179.703 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 3506 ' ' PRO . . . . . 0.541 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 60.1 Cg_endo -80.29 173.65 12.25 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 123.817 3.011 . . . . 0.0 113.504 -178.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3507 ' ' ILE . . . . . 0.487 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 74.8 mt -71.31 135.73 27.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.112 -176.01 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3508 ' ' VAL . . . . . 0.414 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.3 m -101.91 -29.14 3.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.408 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3509 ' ' TRP . . . . . 0.683 ' HB2' HD13 ' A' 3538 ' ' LEU . 74.7 t-105 -151.96 155.11 37.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.641 0.258 . . . . 0.0 110.717 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -148.13 118.93 7.56 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 176.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.86 -130.24 1.15 Allowed Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3512 ' ' LEU . . . . . 0.678 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -139.71 158.05 44.74 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.966 0.412 . . . . 0.0 110.803 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3513 ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' 3519 ' ' THR . 84.1 mt -110.47 149.65 30.0 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 170.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3514 ' ' ALA . . . . . 0.644 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.3 120.96 11.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -177.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3515 ' ' LEU . . . . . 0.709 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.27 145.75 41.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 172.935 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 3516 ' ' LYS . . . . . 0.709 ' HD3' HD12 ' A' 3515 ' ' LEU . 1.3 mptp? 63.64 -95.79 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -168.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -145.27 9.99 1.27 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.681 174.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3518 ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' A' 3514 ' ' ALA . 27.3 m-20 -97.28 129.12 44.62 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.423 -174.344 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3519 ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' 3514 ' ' ALA . 31.8 p -117.1 133.58 55.82 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.14 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -126.05 120.85 31.34 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3521 ' ' ALA . . . . . 0.678 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.17 120.64 18.06 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.086 0.47 . . . . 0.0 109.947 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3522 ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' 3579 ' ' LEU . 26.8 m -129.85 147.71 33.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.625 0.726 . . . . 0.0 111.822 -175.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -110.45 124.94 52.7 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.828 173.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3524 ' ' LEU . . . . . 0.796 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -94.17 109.96 21.72 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.597 -175.136 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 3525 ' ' HIS . . . . . 0.487 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 65.8 m80 -87.58 138.9 31.07 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.747 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3526 ' ' PHE . . . . . 0.701 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.2 t80 -67.56 136.41 54.47 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3527 ' ' VAL . . . . . 0.581 ' CG1' HD23 ' A' 3575 ' ' LEU . 26.1 t -114.68 -55.39 4.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 121.254 0.549 . . . . 0.0 110.765 176.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3528 ' ' SER . . . . . 0.5 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 72.9 m -162.01 172.53 15.8 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.948 -172.435 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.74 -152.21 22.29 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.338 -0.934 . . . . 0.0 112.166 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3530 ' ' ASN . . . . . 0.573 ' HB2' ' HA ' ' A' 3571 ' ' THR . 50.2 t30 -108.34 119.26 38.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.889 0.376 . . . . 0.0 110.463 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -63.41 -27.5 69.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.691 -177.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3532 ' ' VAL . . . . . 0.405 ' HB ' ' ND2' ' A' 3530 ' ' ASN . 62.4 t -57.86 -32.79 44.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.033 0.444 . . . . 0.0 110.649 178.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3533 ' ' LEU . . . . . 0.539 HD23 ' HD3' ' A' 3536 ' ' ARG . 28.3 mt -62.12 -40.61 96.5 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.367 178.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3534 ' ' ALA . . . . . 0.485 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.5 -41.86 92.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.954 0.407 . . . . 0.0 110.195 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -61.03 -37.15 81.58 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.936 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3536 ' ' ARG . . . . . 0.539 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.6 ptm180 -89.78 -7.98 53.18 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3537 ' ' SER . . . . . 0.496 ' HB2' HD11 ' A' 3626 ' ' LEU . 41.1 p -105.14 -40.5 5.85 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.783 0.325 . . . . 0.0 111.621 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3538 ' ' LEU . . . . . 0.683 HD13 ' HB2' ' A' 3509 ' ' TRP . 28.2 mt -79.14 110.3 14.31 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-O 121.281 0.562 . . . . 0.0 109.708 -173.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo . . . . . 0 N--CA 1.459 -0.542 0 C-N-CA 123.123 2.548 . . . . 0.0 113.273 -170.821 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 3546 ' ' PRO . . . . . 0.583 ' HA ' ' O ' ' A' 3512 ' ' LEU . 87.4 Cg_endo . . . . . 0 N--CA 1.455 -0.756 0 CA-C-O 121.228 0.428 . . . . 0.0 112.733 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3547 ' ' LEU . . . . . 0.672 ' HB3' HD13 ' A' 3612 ' ' ILE . 30.3 mt -85.95 115.24 23.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.131 176.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3548 ' ' ARG . . . . . 0.644 ' HA ' ' O ' ' A' 3514 ' ' ALA . 37.7 ptt85 -91.35 140.76 29.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.19 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3549 ' ' ILE . . . . . 0.549 ' CG2' HD22 ' B' 2521 ' ' LEU . 17.3 mt -96.14 107.26 19.45 Favored 'Isoleucine or valine' 0 C--O 1.249 1.045 0 CA-C-O 122.5 1.143 . . . . 0.0 111.458 -177.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3550 ' ' ALA . . . . . 0.56 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -114.94 4.63 14.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.92 -172.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3551 ' ' GLN . . . . . 0.731 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 62.6 mt-30 -155.0 167.22 31.08 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.469 0.308 . . . . 0.0 110.804 177.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3552 ' ' ARG . . . . . 0.686 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -149.03 134.04 18.11 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.072 0.463 . . . . 0.0 111.228 177.508 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 3553 ' ' MET . . . . . 0.623 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 14.6 tmm? -108.76 116.34 31.79 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.329 178.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -65.25 110.24 2.51 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3555 ' ' LEU . . . . . 0.637 ' O ' HD12 ' A' 3555 ' ' LEU . 2.1 pp -69.67 98.71 1.21 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.053 0.93 . . . . 0.0 110.233 -175.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3556 ' ' GLU . . . . . 0.627 ' O ' ' HG ' ' A' 3560 ' ' LEU . 37.4 mt-10 -107.67 167.11 10.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.567 177.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3557 ' ' ALA . . . . . 0.515 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -57.71 -48.19 80.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.902 0.382 . . . . 0.0 110.238 178.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3558 ' ' THR . . . . . . . . . . . . . 1.7 p -62.29 -34.01 75.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.715 178.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3559 ' ' GLN . . . . . 0.551 ' O ' HG23 ' A' 3563 ' ' VAL . 86.8 mm-40 -74.38 -40.04 62.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.868 -179.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3560 ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' 3556 ' ' GLU . 74.9 mt -63.98 -34.18 77.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.4 179.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3561 ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.1 mm-40 -61.71 -45.6 93.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.13 0.49 . . . . 0.0 109.982 174.041 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -58.06 -44.96 94.43 Favored Glycine 0 N--CA 1.453 -0.186 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.214 175.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3563 ' ' VAL . . . . . 0.617 ' O ' ' HG3' ' A' 3567 ' ' MET . 40.2 t -61.83 -50.52 79.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.823 0.344 . . . . 0.0 110.28 177.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3564 ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.45 -31.89 68.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.695 -178.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3565 ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' 3568 ' ' THR . 31.6 ttp85 -54.3 -46.21 72.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.745 178.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3566 ' ' ARG . . . . . 0.428 ' HG2' ' O ' ' A' 3563 ' ' VAL . 16.9 ptt-85 -86.63 -12.74 47.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.872 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3567 ' ' MET . . . . . 0.617 ' HG3' ' O ' ' A' 3563 ' ' VAL . 86.3 mtp -78.25 -27.02 47.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 110.742 178.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3568 ' ' THR . . . . . 0.489 HG22 ' O ' ' A' 3565 ' ' ARG . 7.7 t -82.91 1.34 39.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.197 0.522 . . . . 0.0 110.276 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 51.7 t -128.42 87.41 1.08 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.689 176.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -70.4 109.21 4.63 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3571 ' ' THR . . . . . 0.573 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.4 m 151.17 -38.53 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.418 1.487 . . . . 0.0 108.438 -176.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -82.36 -29.98 30.62 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.263 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3573 ' ' TYR . . . . . 0.739 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -127.25 163.55 23.68 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.873 176.249 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 3574 ' ' CYS . . . . . 0.614 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 28.0 t -128.25 136.48 51.09 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 171.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3575 ' ' LEU . . . . . 0.753 HD22 HD13 ' A' 3642 ' ' LEU . 13.1 tp -106.06 125.61 51.2 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3576 ' ' LEU . . . . . 0.605 HD11 HD11 ' A' 3661 ' ' ILE . 79.7 mt -127.61 155.58 43.63 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.138 0.494 . . . . 0.0 110.825 -177.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3577 ' ' LEU . . . . . 0.706 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -123.03 107.9 12.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.387 179.776 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 3578 ' ' ALA . . . . . 0.492 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.27 123.53 37.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.325 0.584 . . . . 0.0 110.501 -177.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3579 ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' 3522 ' ' VAL . 53.6 mt -124.29 144.24 45.13 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 114.97 -1.013 . . . . 0.0 110.328 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3580 ' ' PRO . . . . . 0.406 ' HA ' ' O ' ' A' 3521 ' ' ALA . 18.2 Cg_endo -60.57 113.06 1.53 Allowed 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.37 2.047 . . . . 0.0 111.452 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.2 p -99.28 107.79 20.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.349 0.595 . . . . 0.0 110.362 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3582 ' ' GLY . . . . . 0.439 ' HA2' ' OD2' ' A' 3587 ' ' ASP . . . -98.28 145.6 17.83 Favored Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.563 179.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3583 ' ' ARG . . . . . 0.404 ' HG2' ' OD2' ' A' 3587 ' ' ASP . 27.2 mmt-85 -64.4 -43.04 95.67 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3584 ' ' ASP . . . . . 0.612 ' O ' HG23 ' A' 3588 ' ' VAL . 5.3 p-10 -134.65 -179.77 5.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.096 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -57.7 -43.6 85.28 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.102 0.251 . . . . 0.0 111.336 -175.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.33 -43.85 89.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.345 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3587 ' ' ASP . . . . . 0.439 ' OD2' ' HA2' ' A' 3582 ' ' GLY . 26.8 t70 -60.84 -44.67 96.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.398 -179.172 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3588 ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' 3584 ' ' ASP . 98.4 t -56.52 -39.82 64.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.71 178.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3589 ' ' VAL . . . . . 0.442 ' O ' ' HG2' ' A' 3593 ' ' GLU . 13.1 t -64.87 -51.1 71.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.582 0.706 . . . . 0.0 109.641 -179.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3590 ' ' SER . . . . . . . . . . . . . 34.3 m -64.32 -37.99 89.46 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.196 -177.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -71.42 -37.17 71.48 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.128 -0.358 . . . . 0.0 111.061 177.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3592 ' ' THR . . . . . . . . . . . . . 89.2 m -63.32 -50.07 71.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.644 0.259 . . . . 0.0 110.818 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3593 ' ' GLU . . . . . 0.547 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 8.8 pt-20 -64.2 -37.11 86.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.97 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3594 ' ' SER . . . . . . . . . . . . . 7.6 t -67.52 -43.12 81.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.822 0.344 . . . . 0.0 110.232 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3595 ' ' LEU . . . . . 0.56 HD12 ' HB2' ' A' 3599 ' ' PHE . 61.4 tp -63.42 -46.63 85.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.101 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3596 ' ' LYS . . . . . 0.832 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 57.5 pttt -67.84 -30.58 70.01 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.008 -177.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.78 -38.44 54.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.729 0.299 . . . . 0.0 111.57 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3598 ' ' ALA . . . . . 0.407 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -93.91 -45.93 7.4 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -171.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3599 ' ' PHE . . . . . 0.56 ' HB2' HD12 ' A' 3595 ' ' LEU . 12.0 m-85 -98.97 -50.07 4.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.651 0.262 . . . . 0.0 111.683 -175.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3600 ' ' ILE . . . . . 0.832 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.6 mm -61.88 -60.08 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.261 -175.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3601 ' ' THR . . . . . . . . . . . . . 74.8 m -53.29 -40.92 65.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.675 0.274 . . . . 0.0 111.089 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3602 ' ' TYR . . . . . 0.78 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -64.71 -57.07 9.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.082 179.503 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 3603 ' ' LEU . . . . . 0.78 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.1 OUTLIER -57.99 -41.62 83.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.644 0.259 . . . . 0.0 111.43 -177.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -72.66 -36.09 67.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.567 -176.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.74 68.44 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.942 0.401 . . . . 0.0 110.961 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -81.2 -19.1 44.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.78 177.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3607 ' ' GLN . . . . . 0.551 ' O ' ' HG ' ' A' 3555 ' ' LEU . 46.3 mt-30 50.39 52.06 15.57 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -171.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3608 ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' 3603 ' ' LEU . . . -135.45 -176.19 4.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.193 -171.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3609 ' ' ALA . . . . . 0.686 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.4 117.97 29.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.537 176.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -65.24 102.4 0.66 Allowed Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.244 -0.742 . . . . 0.0 111.244 177.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3611 ' ' ILE . . . . . 0.731 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 32.4 mm -89.3 126.18 42.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-O 121.201 0.525 . . . . 0.0 110.762 -175.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3612 ' ' ILE . . . . . 0.672 HD13 ' HB3' ' A' 3547 ' ' LEU . 34.1 mt -122.07 112.92 36.74 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.221 177.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 15.5 m120 -84.64 111.7 19.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.121 -179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 C--N 1.321 -0.641 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.662 179.604 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 3624 ' ' TYR . . . . . . . . . . . . . 80.7 m-85 . . . . . 0 N--CA 1.449 -0.49 0 CA-C-O 120.927 0.394 . . . . 0.0 109.962 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A 3625 ' ' VAL . . . . . 0.455 HG13 HG23 ' A' 3611 ' ' ILE . 3.1 t -118.97 115.57 48.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.067 179.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3626 ' ' LEU . . . . . 0.629 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -97.82 113.79 25.68 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 169.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3627 ' ' GLN . . . . . 0.575 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 95.0 mt-30 -94.48 111.42 23.17 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.225 -178.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3628 ' ' ILE . . . . . 0.595 HG12 HG12 ' A' 3659 ' ' ILE . 40.9 mt -92.08 98.22 8.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.034 178.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -88.96 141.94 29.94 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.855 178.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3630 ' ' PRO . . . . . 0.604 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.6 Cg_endo -70.83 169.24 20.75 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 122.487 2.125 . . . . 0.0 111.414 176.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -68.0 74.31 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.684 2.256 . . . . 0.0 111.833 176.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3632 ' ' CYS . . . . . 0.587 ' O ' ' HG2' ' A' 3636 ' ' GLU . 9.0 p -111.69 163.34 14.23 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.642 -174.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -47.69 -41.66 23.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.738 177.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 39.1 t80 -53.91 -52.42 60.59 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.441 177.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3635 ' ' SER . . . . . . . . . . . . . 56.4 p -70.29 -53.55 16.38 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.686 -177.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3636 ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.1 mm-40 -56.21 -44.76 79.82 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 123.445 0.466 . . . . 0.0 111.072 -174.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3637 ' ' SER . . . . . . . . . . . . . 48.4 t -61.97 -53.11 60.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.565 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 43.2 m80 -61.62 -34.86 76.4 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.573 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.55 -31.3 71.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.315 177.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3640 ' ' SER . . . . . 0.635 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 21.8 m -71.16 -29.91 65.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.33 0.586 . . . . 0.0 110.035 -178.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -89.05 -44.57 10.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.424 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3642 ' ' LEU . . . . . 0.753 HD13 HD22 ' A' 3575 ' ' LEU . 22.8 mt -78.48 -30.85 47.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.246 -0.434 . . . . 0.0 112.17 -173.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3643 ' ' ALA . . . . . 0.459 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -150.78 69.54 8.55 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.456 0.17 . . . . 0.0 111.369 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.0 -19.39 66.4 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.417 2.078 . . . . 0.0 111.731 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3645 ' ' ASP . . . . . 0.447 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 18.1 m-20 -72.83 -51.42 18.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.204 -177.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3646 ' ' LEU . . . . . 0.706 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -79.5 -29.94 41.77 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.183 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 3647 ' ' LEU . . . . . 0.635 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -54.26 -45.72 72.48 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.424 178.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.32 -31.13 69.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.96 0.409 . . . . 0.0 111.119 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3649 ' ' SER . . . . . . . . . . . . . 15.3 m -76.78 -36.56 56.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.852 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3650 ' ' ILE . . . . . 0.761 ' HA ' HG22 ' A' 3653 ' ' ILE . 7.0 pt -83.5 -9.89 11.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.925 0.393 . . . . 0.0 111.293 -176.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3651 ' ' SER . . . . . . . . . . . . . 8.3 t -60.18 -25.53 65.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.329 176.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 17.9 m120 -88.01 -32.56 18.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.033 0.444 . . . . 0.0 110.305 175.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3653 ' ' ILE . . . . . 0.761 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.4 OUTLIER -104.68 36.1 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-O 122.847 1.308 . . . . 0.0 109.16 -177.121 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A 3654 ' ' SER . . . . . 0.428 ' N ' ' HD2' ' A' 3655 ' ' PRO . 49.5 m -30.31 -45.61 0.26 Allowed Pre-proline 0 N--CA 1.473 0.701 0 CA-C-N 113.966 -1.47 . . . . 0.0 114.433 172.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3655 ' ' PRO . . . . . 0.547 ' HG2' HD13 ' A' 3653 ' ' ILE . 11.9 Cg_endo -58.28 80.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 121.826 1.684 . . . . 0.0 111.842 169.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -146.91 169.39 19.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.762 -176.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3657 ' ' LEU . . . . . 0.492 HD22 HG22 ' A' 3628 ' ' ILE . 50.3 mt -121.64 137.15 54.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.656 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.3 tmm? -104.39 112.55 25.64 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3659 ' ' ILE . . . . . 0.796 HD12 HD21 ' A' 3524 ' ' LEU . 73.1 mt -106.62 121.27 59.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.237 0.542 . . . . 0.0 111.59 -171.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3660 ' ' VAL . . . . . 0.739 HG13 ' HD2' ' A' 3573 ' ' TYR . 79.5 t -104.47 116.43 48.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.914 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3661 ' ' ILE . . . . . 0.629 HG12 ' HG ' ' A' 3626 ' ' LEU . 73.4 mt -91.07 115.72 30.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 176.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -122.96 133.58 54.37 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.226 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.1 m -78.49 110.19 13.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A 3664 ' ' VAL . . . . . 0.432 HG11 HG23 ' A' 3625 ' ' VAL . 3.4 p . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.921 -1.038 . . . . 0.0 111.262 -175.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 2518 ' ' TYR . . . . . 0.575 ' CD1' ' HB2' ' A' 3553 ' ' MET . 7.6 m-85 . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 119.17 -0.443 . . . . 0.0 112.144 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B 2519 ' ' GLU . . . . . 0.552 ' HG2' ' HE ' ' A' 3552 ' ' ARG . 30.6 tt0 44.49 95.94 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 172.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B 2520 ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' 3550 ' ' ALA . 17.5 p -57.64 131.12 49.29 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 122.291 -0.256 . . . . 0.0 111.189 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B 2521 ' ' LEU . . . . . 0.56 ' H ' ' C ' ' A' 3550 ' ' ALA . 16.7 tp . . . . . 0 C--O 1.234 0.238 0 C-N-CA 121.178 -0.209 . . . . 0.0 110.558 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.863 HG13 ' HB3' ' A' 3649 ' ' SER . 95.3 t . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 20.7 t70 -105.84 111.21 23.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.006 0.431 . . . . 0.0 110.126 179.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . 0.492 ' O ' HD12 ' A' 3502 ' ' LEU . 67.7 mtm -81.57 -20.33 40.1 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.436 179.683 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.444 ' HA ' HD12 ' A' 3502 ' ' LEU . 21.5 t -65.8 -26.87 39.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.408 -172.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -77.16 -55.91 5.02 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.389 0.614 . . . . 0.0 110.279 172.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.61 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.0 pp -72.03 -31.97 66.68 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.493 -168.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.619 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.25 -16.23 63.01 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 120.284 -0.566 . . . . 0.0 110.234 -174.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.619 ' N ' HD13 ' A' 3502 ' ' LEU . 73.6 mmtt -72.0 -25.05 61.68 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.312 179.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 85.3 mttt -104.41 -44.53 4.9 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.507 0.67 . . . . 0.0 110.511 177.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.756 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -142.47 94.33 6.81 Favored Pre-proline 0 N--CA 1.435 -1.191 0 CA-C-N 115.087 -0.96 . . . . 0.0 111.192 -176.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -80.64 174.17 11.41 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 123.811 3.007 . . . . 0.0 113.432 -178.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.461 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.2 mt -70.57 136.81 25.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.792 -178.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 28.6 m -108.02 -20.33 6.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.699 -177.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.788 ' HE3' HD12 ' A' 3524 ' ' LEU . 24.2 t90 -159.69 153.16 22.45 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-O 120.643 0.259 . . . . 0.0 110.388 -176.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -148.27 119.9 8.02 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 177.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -172.91 -129.65 1.17 Allowed Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.743 -0.741 . . . . 0.0 111.515 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.646 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -140.01 155.86 46.89 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.073 0.463 . . . . 0.0 111.196 -179.305 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.524 HD23 ' HB2' ' A' 3547 ' ' LEU . 83.2 mt -107.63 152.43 24.3 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.034 -1.098 . . . . 0.0 108.034 168.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.636 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -146.86 122.47 10.46 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -178.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.598 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.89 145.21 41.86 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 171.6 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.598 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.1 OUTLIER 59.83 -96.16 0.06 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.989 0.423 . . . . 0.0 110.069 -168.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 21.0 m-80 -143.68 8.49 1.52 Allowed 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 177.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -102.35 122.42 44.22 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.14 -173.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 66.6 p -108.62 152.7 24.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.104 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -141.61 114.75 8.71 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.193 173.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.646 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -69.01 117.2 10.36 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 176.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.421 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.9 m -131.31 148.16 32.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.426 -177.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 25.1 pt20 -112.57 132.88 54.91 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.042 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.891 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -100.64 113.11 25.67 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-O 121.408 0.623 . . . . 0.0 112.189 -173.087 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.461 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 83.0 m-70 -87.32 137.56 32.24 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.481 174.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.756 ' O ' ' HB2' ' A' 3505 ' ' TYR . 62.1 t80 -66.14 139.83 58.17 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 174.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.604 ' CG1' HD23 ' A' 3575 ' ' LEU . 16.2 t -116.62 -55.64 4.1 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.714 0 CA-C-O 121.362 0.601 . . . . 0.0 111.304 175.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.426 ' HB3' ' HB3' ' A' 3575 ' ' LEU . 13.6 t -158.02 170.14 22.97 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.442 -0.799 . . . . 0.0 109.917 -169.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.03 -152.23 24.43 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.86 175.74 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.434 ' HB2' ' HA ' ' A' 3571 ' ' THR . 52.2 t-20 -97.95 114.58 26.73 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -179.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -64.21 -28.22 69.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.73 0.3 . . . . 0.0 111.356 -177.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 60.9 t -64.84 -31.12 52.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.827 0.346 . . . . 0.0 110.442 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.521 HD23 ' HD3' ' A' 3536 ' ' ARG . 18.5 mt -57.31 -39.0 74.91 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.91 176.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.458 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -70.83 -44.62 66.12 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.852 0.358 . . . . 0.0 110.498 -179.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 59.0 t60 -60.76 -32.51 71.81 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.023 -179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.521 ' HD3' HD23 ' A' 3533 ' ' LEU . 14.1 ptm180 -89.07 -18.27 27.62 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -177.523 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.483 ' HB2' HG21 ' A' 3614 ' ' VAL . 42.3 p -98.66 -39.07 8.86 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 122.128 -0.357 . . . . 0.0 111.428 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.689 HD13 ' HB2' ' A' 3509 ' ' TRP . 30.6 mt -80.27 110.69 17.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.272 -174.066 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -80.67 160.6 21.89 Favored 'Trans proline' 0 N--CA 1.462 -0.325 0 C-N-CA 123.351 2.701 . . . . 0.0 112.882 -172.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.73 ' HA ' ' HD2' ' A' 3545 ' ' PRO . 1.3 pt? -159.14 165.87 32.79 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.293 -179.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 49.8 m -162.15 -47.25 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.13 -0.941 . . . . 0.0 109.084 176.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . 0.485 ' CD ' ' H ' ' A' 3542 ' ' GLU . 0.0 OUTLIER -108.31 -30.34 8.39 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.867 -1.061 . . . . 0.0 109.149 176.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . -176.88 -32.71 0.05 OUTLIER Glycine 0 N--CA 1.442 -0.912 0 CA-C-N 113.869 -1.514 . . . . 0.0 110.737 179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . 0.419 ' HA2' ' HA ' ' A' 3540 ' ' LEU . . . 154.98 100.1 0.18 Allowed Glycine 0 N--CA 1.445 -0.725 0 C-N-CA 121.233 -0.508 . . . . 0.0 111.992 178.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.73 ' HD2' ' HA ' ' A' 3540 ' ' LEU . 18.6 Cg_endo -58.28 146.49 88.96 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.959 2.439 . . . . 0.0 112.052 178.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.596 ' HA ' ' O ' ' A' 3512 ' ' LEU . 15.9 Cg_endo -57.24 120.14 7.87 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.841 2.361 . . . . 0.0 112.799 -177.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.706 ' HB3' HD13 ' A' 3612 ' ' ILE . 29.4 mt -68.92 116.4 9.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.333 177.181 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.636 ' HA ' ' O ' ' A' 3514 ' ' ALA . 16.9 ptt180 -90.35 139.07 31.02 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.36 -175.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.488 HD12 HD22 ' A' 3515 ' ' LEU . 31.7 mt -93.1 105.86 17.28 Favored 'Isoleucine or valine' 0 C--O 1.242 0.688 0 CA-C-O 122.066 0.936 . . . . 0.0 110.555 179.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -103.84 -14.56 15.98 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.45 -171.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.689 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 96.1 mt-30 -146.78 177.65 8.94 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.477 -0.328 . . . . 0.0 110.697 -177.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.738 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -152.82 140.95 20.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.879 0.371 . . . . 0.0 111.689 -178.94 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.658 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 17.2 ttt -111.41 110.48 20.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.727 176.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 13.2 mmt180 -61.67 110.7 1.58 Allowed 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.788 -0.449 . . . . 0.0 109.788 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.505 ' O ' HD12 ' A' 3555 ' ' LEU . 2.4 pp -75.2 98.82 3.84 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.007 0.908 . . . . 0.0 110.023 -176.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.707 ' O ' ' HG ' ' A' 3560 ' ' LEU . 33.6 mt-10 -101.54 162.59 12.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.878 -1.055 . . . . 0.0 109.122 174.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.502 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -59.9 -38.02 81.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.138 0.494 . . . . 0.0 109.805 177.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 3.1 p -66.98 -41.08 87.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.162 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.676 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 77.6 mm-40 -63.68 -42.93 97.97 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.068 177.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.707 ' HG ' ' O ' ' A' 3556 ' ' GLU . 78.2 mt -60.83 -32.93 72.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.315 -178.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.631 ' O ' ' HD3' ' A' 3565 ' ' ARG . 10.9 mm-40 -60.95 -50.78 71.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.211 0.529 . . . . 0.0 109.72 173.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.28 -41.48 99.52 Favored Glycine 0 N--CA 1.452 -0.248 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.067 178.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.538 HG23 ' O ' ' A' 3559 ' ' GLN . 69.3 t -60.47 -48.28 89.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 176.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -58.51 -37.69 76.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.247 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.631 ' HD3' ' O ' ' A' 3561 ' ' GLU . 5.1 mpt_? -59.45 -41.73 90.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.236 179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 24.7 ptt180 -88.2 -9.93 51.47 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.724 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.514 ' HG3' ' O ' ' A' 3563 ' ' VAL . 84.5 mtp -83.22 -29.41 28.52 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.939 0.4 . . . . 0.0 110.531 176.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . 0.486 HG22 ' O ' ' A' 3565 ' ' ARG . 7.0 t -75.41 -15.1 60.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.065 0.46 . . . . 0.0 110.228 -178.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 46.0 t -103.12 87.0 1.09 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.491 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.958 177.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -74.4 107.64 6.68 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.434 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.1 m 155.68 -42.11 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 125.227 1.411 . . . . 0.0 107.662 -172.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -82.03 -30.91 31.23 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.48 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.854 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -126.67 164.03 22.19 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.201 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.615 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 38.3 t -127.59 135.59 50.49 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 171.511 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.789 HD22 HD13 ' A' 3642 ' ' LEU . 12.8 tp -106.27 125.8 51.44 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.613 HD11 HD11 ' A' 3661 ' ' ILE . 79.4 mt -127.59 154.66 44.95 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 121.158 0.504 . . . . 0.0 110.693 -177.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.699 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -119.75 109.76 15.99 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 179.135 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.527 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.55 119.74 33.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.366 0.603 . . . . 0.0 110.391 -179.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.492 ' HG ' HD12 ' A' 3577 ' ' LEU . 59.0 mt -119.4 142.92 33.4 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-N 114.721 -1.127 . . . . 0.0 109.987 178.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -58.65 113.35 1.52 Allowed 'Trans proline' 0 N--CA 1.464 -0.239 0 C-N-CA 122.437 2.091 . . . . 0.0 111.612 178.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.5 p -96.38 106.01 18.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.483 0.659 . . . . 0.0 110.448 -178.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -102.09 147.72 17.42 Favored Glycine 0 N--CA 1.439 -1.133 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.652 178.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 48.1 ttp180 -58.75 -43.47 90.3 Favored 'General case' 0 N--CA 1.428 -1.558 0 CA-C-O 121.371 0.605 . . . . 0.0 110.421 176.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.631 ' O ' HG23 ' A' 3588 ' ' VAL . 3.9 p30 -142.23 177.77 8.01 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.012 -0.995 . . . . 0.0 108.97 178.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . 0.418 ' O ' HG23 ' A' 3589 ' ' VAL . 64.4 tt0 -51.93 -46.36 64.64 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 123.512 0.508 . . . . 0.0 111.53 -176.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -62.57 -46.66 87.34 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.409 179.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . . . . . . . . . 22.8 t70 -60.54 -41.43 94.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.06 0.457 . . . . 0.0 110.632 -179.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.631 HG23 ' O ' ' A' 3584 ' ' ASP . 96.1 t -57.54 -45.27 86.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.574 177.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' 3585 ' ' GLN . 83.0 t -57.76 -46.16 86.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.697 178.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 14.3 t -64.09 -42.88 96.76 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.724 -178.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . 0.581 ' NE2' ' H ' ' A' 3521 ' ' ALA . 13.4 mm100 -65.22 -39.94 93.44 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.628 178.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . 0.431 ' O ' ' HG3' ' A' 3596 ' ' LYS . 31.6 m -61.85 -45.43 93.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.082 177.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -59.77 -50.09 75.18 Favored 'General case' 0 N--CA 1.439 -0.998 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.921 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 61.3 m -61.08 -45.24 95.53 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.936 178.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.541 HD12 ' HB2' ' A' 3599 ' ' PHE . 44.8 tp -61.71 -45.33 94.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.072 -177.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.602 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 51.8 mtmt -57.95 -44.95 87.3 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.085 -179.615 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.88 -38.32 53.84 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.906 -175.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -89.69 -46.96 8.25 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.805 0.668 . . . . 0.0 112.805 -170.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.541 ' HB2' HD12 ' A' 3595 ' ' LEU . 22.9 m-85 -100.24 -50.84 3.82 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.721 0.296 . . . . 0.0 111.505 -175.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.602 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 32.4 mm -60.67 -58.91 5.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.841 -175.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 87.0 m -60.12 -42.57 95.06 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.363 -178.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.496 ' HE1' HD11 ' B' 2521 ' ' LEU . 40.4 t80 -65.3 -53.59 41.72 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 121.25 -0.18 . . . . 0.0 111.044 -178.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.535 HD12 ' O ' ' A' 3608 ' ' ALA . 0.3 OUTLIER -61.74 -37.15 83.17 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.568 0.223 . . . . 0.0 111.457 -176.599 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -76.73 -30.71 56.72 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 -179.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -66.78 -36.24 81.94 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 121.164 0.506 . . . . 0.0 110.427 176.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 71.9 mmtt -82.1 -18.49 42.81 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.589 178.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 50.05 54.52 10.94 Favored 'General case' 0 C--O 1.232 0.158 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -168.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.535 ' O ' HD12 ' A' 3603 ' ' LEU . . . -136.05 -177.79 4.85 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.857 -172.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.738 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -116.67 120.2 37.87 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.959 176.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . 0.465 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.19 103.64 0.76 Allowed Glycine 0 N--CA 1.445 -0.722 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 176.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.689 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 34.1 mm -89.36 117.84 33.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.239 0.542 . . . . 0.0 110.647 -174.584 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.706 HD13 ' HB3' ' A' 3547 ' ' LEU . 17.5 mt -113.74 117.2 54.81 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.947 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.225 178.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.508 ' HA ' ' O ' ' A' 3624 ' ' TYR . 10.0 m120 -92.38 117.42 29.9 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.758 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.483 HG21 ' HB2' ' A' 3537 ' ' SER . 31.5 m -116.64 147.94 40.86 Favored Pre-proline 0 C--N 1.32 -0.712 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.249 176.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.542 ' HA ' ' O ' ' A' 3621 ' ' GLN . 71.8 Cg_endo -91.03 143.25 3.23 Favored 'Trans proline' 0 N--CA 1.445 -1.382 0 C-N-CA 122.21 1.94 . . . . 0.0 111.602 171.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . . . . . . . . . 8.2 t30 -75.12 130.15 81.22 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 175.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -50.11 118.68 4.12 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 123.441 2.76 . . . . 0.0 112.585 -178.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 96.04 -30.31 8.74 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.288 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 7.4 m -89.5 -34.71 16.3 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.779 0.323 . . . . 0.0 110.286 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 94.0 m-20 63.26 16.45 9.45 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 115.659 -0.701 . . . . 0.0 112.337 174.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.542 ' O ' ' HA ' ' A' 3615 ' ' PRO . 15.8 mm-40 -99.03 117.23 64.57 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 176.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.482 ' HA ' ' O ' ' A' 3614 ' ' VAL . 74.0 Cg_endo -74.69 25.67 0.36 Allowed 'Trans proline' 0 CA--C 1.53 0.28 0 C-N-CA 123.468 2.779 . . . . 0.0 113.04 -178.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -77.08 32.26 0.14 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.051 0.453 . . . . 0.0 111.786 -176.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.508 ' O ' ' HA ' ' A' 3613 ' ' ASN . 38.5 m-85 -120.08 133.09 55.62 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 177.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.513 HG13 HG23 ' A' 3611 ' ' ILE . 8.1 t -116.98 114.55 46.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.612 -177.288 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.634 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -97.86 112.72 24.53 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 169.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.523 ' HB2' ' HB ' ' A' 3660 ' ' VAL . 40.5 mt-30 -94.21 110.98 22.68 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.008 -176.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.603 HG12 HG12 ' A' 3659 ' ' ILE . 43.5 mt -91.99 98.33 8.25 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.921 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.341 178.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -89.23 137.51 29.26 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.767 177.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -65.31 171.14 9.65 Favored 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.755 2.304 . . . . 0.0 111.68 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -72.42 52.98 2.08 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.671 2.248 . . . . 0.0 112.438 177.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 17.8 p -85.42 162.24 19.08 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.53 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -48.66 -45.83 39.34 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.597 0.561 . . . . 0.0 111.111 -179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 16.7 t80 -48.94 -46.29 43.06 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.421 177.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 7.4 m -64.67 -53.97 39.05 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.833 -177.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -64.42 -33.13 75.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.155 -175.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 38.4 m -63.38 -48.6 77.23 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.106 0.479 . . . . 0.0 110.455 -179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 42.7 m-70 -68.46 -37.66 80.38 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.376 -0.374 . . . . 0.0 110.358 177.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 74.0 mt -62.43 -41.76 98.95 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.667 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 5.1 p -68.35 -30.87 69.92 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.022 0.439 . . . . 0.0 110.831 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 24.7 ttt180 -79.61 -38.62 33.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.122 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.789 HD13 HD22 ' A' 3575 ' ' LEU . 19.4 mt -86.39 -37.31 18.52 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -174.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.446 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -144.23 74.85 15.65 Favored Pre-proline 0 C--N 1.324 -0.537 0 N-CA-C 111.88 0.326 . . . . 0.0 111.88 -176.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.92 -21.33 57.32 Favored 'Trans proline' 0 C--O 1.233 0.242 0 C-N-CA 122.517 2.144 . . . . 0.0 111.828 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . 0.566 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.6 m-20 -73.36 -44.66 58.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.488 -177.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.699 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -84.5 -31.21 24.61 Favored 'General case' 0 N--CA 1.446 -0.675 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 177.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.667 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.2 tm? -53.78 -41.31 67.07 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.577 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -64.55 -18.14 64.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.875 -178.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.863 ' HB3' HG13 ' A' 3496 ' ' VAL . 72.4 m -90.38 -34.32 15.71 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.824 0.345 . . . . 0.0 111.024 176.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.653 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.8 pt -83.8 -13.36 11.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.902 -0.319 . . . . 0.0 111.688 -174.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 33.7 p -58.34 -28.5 65.13 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.059 0.457 . . . . 0.0 110.867 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 10.1 m120 -88.75 -33.09 17.6 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.074 176.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.653 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.4 tp -105.19 37.54 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-O 122.218 1.008 . . . . 0.0 109.398 -179.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.491 ' N ' ' HD2' ' A' 3655 ' ' PRO . 7.9 m -35.72 -43.59 0.77 Allowed Pre-proline 0 CA--C 1.54 0.576 0 CA-C-N 114.15 -1.386 . . . . 0.0 113.916 173.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' 3654 ' ' SER . 15.0 Cg_endo -59.24 81.59 0.05 OUTLIER 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 121.925 1.75 . . . . 0.0 112.213 170.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . 0.461 ' CB ' HD23 ' A' 3579 ' ' LEU . 34.3 p80 -155.18 179.7 8.9 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.734 -179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.458 HD22 HG22 ' A' 3628 ' ' ILE . 23.6 mt -122.75 147.86 46.01 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.768 -177.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.6 ttp -108.22 110.08 21.62 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 174.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.891 HD12 HD21 ' A' 3524 ' ' LEU . 78.2 mt -103.59 120.49 53.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 CA-C-O 121.149 0.499 . . . . 0.0 111.597 -172.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.854 HG13 ' HD2' ' A' 3573 ' ' TYR . 95.6 t -105.6 115.94 48.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 115.352 -0.84 . . . . 0.0 110.995 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.634 HG12 ' HG ' ' A' 3626 ' ' LEU . 60.2 mt -90.61 112.4 24.92 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.6 127.85 56.22 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.985 0.422 . . . . 0.0 111.721 -175.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 22.3 m -81.24 114.39 20.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.108 170.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 52.0 t . . . . . 0 C--O 1.247 0.951 0 CA-C-O 118.326 -0.845 . . . . 0.0 109.97 -174.422 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.542 ' CD1' ' HB2' ' A' 3553 ' ' MET . 69.8 m-85 . . . . . 0 N--CA 1.48 1.037 0 CA-C-O 119.754 -0.165 . . . . 0.0 111.418 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.671 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 38.6 mt-10 53.56 -157.44 0.17 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.719 0.771 . . . . 0.0 111.348 177.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.42 ' H ' ' HB3' ' B' 2519 ' ' GLU . 33.3 m -144.81 114.09 7.04 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 166.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.663 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.5 OUTLIER -75.27 -127.8 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 -176.896 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.543 ' N ' HD23 ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . 0.517 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 6.9 p-10 -124.37 -108.26 0.33 Allowed 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.76 -171.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.861 -0.59 . . . . 0.0 110.694 -174.669 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.672 HG13 ' HB3' ' A' 3649 ' ' SER . 48.4 t . . . . . 0 N--CA 1.478 0.947 0 N-CA-C 110.373 -0.232 . . . . 0.0 110.373 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 32.0 t70 -106.18 113.86 27.65 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.862 0.363 . . . . 0.0 110.253 177.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . 0.447 ' O ' HD12 ' A' 3502 ' ' LEU . 4.6 mpp? -81.69 -11.77 58.93 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.524 -177.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.418 ' HA ' HD12 ' A' 3502 ' ' LEU . 58.6 t -65.45 -24.46 34.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.334 0 CA-C-O 121.305 0.574 . . . . 0.0 111.296 -176.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -79.31 -60.87 2.2 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.969 0.414 . . . . 0.0 110.677 176.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.609 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.7 pp -61.97 -36.47 81.55 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -174.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.647 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.15 -15.84 63.01 Favored 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 120.143 -0.623 . . . . 0.0 110.467 -171.52 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.647 ' N ' HD13 ' A' 3502 ' ' LEU . 0.1 OUTLIER -72.17 -19.48 61.74 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 177.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.657 ' HD2' ' N ' ' A' 3504 ' ' LYS . 0.0 OUTLIER -104.84 -42.38 5.37 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 178.073 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.73 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.5 103.04 3.48 Favored Pre-proline 0 N--CA 1.446 -0.631 0 CA-C-N 115.142 -0.936 . . . . 0.0 111.214 178.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . 0.444 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 98.3 Cg_endo -84.99 174.96 6.95 Favored 'Trans proline' 0 CA--C 1.531 0.367 0 C-N-CA 124.369 3.38 . . . . 0.0 113.726 -177.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.542 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.1 mt -71.3 136.36 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.432 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.416 HG13 ' HB2' ' A' 3526 ' ' PHE . 29.4 m -104.01 -22.85 4.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.344 179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.651 ' HB2' HD13 ' A' 3538 ' ' LEU . 77.1 t-105 -157.73 150.23 22.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.528 -0.305 . . . . 0.0 110.734 -177.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -144.29 118.33 9.44 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 176.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.89 -129.53 1.09 Allowed Glycine 0 N--CA 1.441 -0.969 0 N-CA-C 111.268 -0.733 . . . . 0.0 111.268 -177.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.622 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -141.64 151.46 43.1 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 121.186 0.517 . . . . 0.0 111.23 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.501 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.4 mt -105.2 148.79 26.55 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 169.443 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.673 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.55 124.95 13.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.691 0.281 . . . . 0.0 111.639 -177.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.761 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.56 142.42 41.34 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 173.839 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.761 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 60.38 -91.25 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 122.904 0.482 . . . . 0.0 109.98 -170.465 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -143.84 9.09 1.51 Allowed 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -99.14 131.02 45.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.817 -174.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.409 HG22 ' HB2' ' A' 3514 ' ' ALA . 31.1 p -119.54 145.28 46.5 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.498 -177.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -140.45 116.75 10.64 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 174.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.622 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.61 120.85 16.85 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.107 0.479 . . . . 0.0 110.078 177.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 27.5 m -128.87 148.57 33.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-O 121.562 0.696 . . . . 0.0 111.852 -175.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -110.31 125.48 53.2 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.986 -1.006 . . . . 0.0 108.621 172.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.849 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -96.89 107.82 20.4 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-O 121.227 0.537 . . . . 0.0 111.676 -175.378 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.542 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 62.6 m-70 -85.07 138.25 32.54 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.278 -0.874 . . . . 0.0 109.134 175.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.73 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.1 t80 -66.71 137.76 56.91 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 174.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.584 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.0 t -114.94 -58.11 3.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-O 121.407 0.622 . . . . 0.0 110.617 176.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.482 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 67.5 m -158.99 172.16 18.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.079 -170.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.13 -156.64 28.59 Favored Glycine 0 N--CA 1.453 -0.186 0 C-N-CA 120.614 -0.803 . . . . 0.0 112.776 177.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.535 ' HB2' ' HA ' ' A' 3571 ' ' THR . 37.9 t30 -100.23 110.92 23.18 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 110.414 -0.217 . . . . 0.0 110.414 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 6.6 p30 -62.89 -26.15 68.64 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.463 -175.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . 0.545 ' O ' ' HG2' ' A' 3536 ' ' ARG . 80.2 t -58.4 -35.42 54.0 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 CA-C-O 120.787 0.327 . . . . 0.0 110.418 179.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.559 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 40.1 mt -58.19 -42.45 86.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.031 178.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.449 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.09 -41.83 94.63 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 120.954 0.407 . . . . 0.0 110.432 -179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 22.8 t60 -58.7 -41.59 86.65 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.854 -178.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' 3532 ' ' VAL . 14.2 ptp180 -89.5 -9.84 48.49 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -177.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.538 ' HB2' HD11 ' A' 3626 ' ' LEU . 33.7 p -99.82 -34.32 10.2 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 120.779 -0.368 . . . . 0.0 111.126 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.651 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.7 mt -81.33 104.62 3.08 Favored Pre-proline 0 C--N 1.32 -0.698 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . 0.425 ' HD3' ' O ' ' A' 3537 ' ' SER . 57.3 Cg_endo -73.7 140.61 29.6 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 123.223 2.615 . . . . 0.0 114.763 -165.682 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.436 HD22 ' CZ3' ' A' 3509 ' ' TRP . 1.0 OUTLIER -159.42 149.87 19.24 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.243 -1.344 . . . . 0.0 110.451 172.275 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 68.3 m -161.55 -38.37 0.04 OUTLIER 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 114.986 -1.006 . . . . 0.0 108.974 172.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -145.17 98.03 3.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.051 178.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 87.83 -63.9 3.74 Favored Glycine 0 N--CA 1.448 -0.535 0 CA-C-N 115.737 -0.665 . . . . 0.0 112.237 -178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 120.15 103.07 1.95 Allowed Glycine 0 N--CA 1.449 -0.479 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.975 -178.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.467 ' HA ' ' HD3' ' A' 3546 ' ' PRO . 4.9 Cg_exo -77.21 150.04 28.74 Favored 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 123.234 2.623 . . . . 0.0 112.376 -178.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 12.1 Cg_exo -70.89 150.11 60.79 Favored 'Trans proline' 0 N--CA 1.462 -0.37 0 C-N-CA 122.81 2.34 . . . . 0.0 111.963 176.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.689 ' HB3' HD13 ' A' 3612 ' ' ILE . 37.5 mt -81.58 115.73 21.0 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.912 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' A' 3514 ' ' ALA . 29.1 ptt85 -90.45 140.46 29.7 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.2 -178.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.473 ' HA ' HG12 ' A' 3612 ' ' ILE . 17.6 mt -92.39 107.86 19.49 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 CA-C-O 121.944 0.878 . . . . 0.0 110.617 179.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.55 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.04 -3.17 14.83 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.064 -172.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.679 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 21.2 mt-30 -151.39 173.19 14.83 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.402 0.144 . . . . 0.0 111.127 179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.681 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.42 139.65 17.54 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.847 0.356 . . . . 0.0 111.269 -179.658 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.668 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 16.5 ttt -109.17 142.67 39.64 Favored 'General case' 0 C--O 1.216 -0.664 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.101 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -77.66 110.94 12.93 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.634 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -76.86 97.76 4.66 Favored 'General case' 0 N--CA 1.449 -0.501 0 C-N-CA 118.858 -1.137 . . . . 0.0 109.109 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.637 ' HB2' ' HG2' ' A' 3559 ' ' GLN . 19.4 mm-40 -115.94 165.07 13.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.523 179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.589 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.48 -54.6 38.8 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.176 0.297 . . . . 0.0 111.301 -178.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 27.0 p -62.48 -38.29 89.3 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.963 0.411 . . . . 0.0 111.305 179.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.637 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 29.1 mm-40 -65.97 -46.86 76.53 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.995 -177.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' 3556 ' ' GLU . 92.0 mt -63.57 -32.01 73.35 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.084 -178.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.589 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.6 mm-40 -65.34 -46.11 81.53 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.236 0.541 . . . . 0.0 109.952 175.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.97 -41.17 99.64 Favored Glycine 0 N--CA 1.452 -0.275 0 CA-C-N 115.255 -0.884 . . . . 0.0 112.099 176.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.532 ' O ' ' HG3' ' A' 3567 ' ' MET . 80.8 t -59.63 -45.67 94.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.903 0.382 . . . . 0.0 110.217 175.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.89 -30.04 68.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.737 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 3.0 mpt_? -62.35 -37.47 85.78 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -88.01 -7.79 56.56 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.646 176.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.532 ' HG3' ' O ' ' A' 3563 ' ' VAL . 80.6 mtp -87.21 -24.25 24.49 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.619 177.591 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 31.0 p -81.87 -22.43 36.93 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.233 0.539 . . . . 0.0 110.275 177.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 39.7 t -93.26 80.41 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.644 176.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -67.21 109.2 2.98 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.01 179.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.535 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.0 m 151.77 -40.86 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 125.587 1.555 . . . . 0.0 108.016 -175.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -86.3 -17.51 34.41 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.689 -179.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.778 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -136.2 163.12 31.11 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.028 0.442 . . . . 0.0 109.976 177.497 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.594 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 43.7 t -126.32 135.63 51.73 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 171.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.77 HD22 HD13 ' A' 3642 ' ' LEU . 14.8 tp -105.4 125.89 51.5 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 -179.648 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.576 HD11 HD11 ' A' 3661 ' ' ILE . 73.5 mt -127.16 154.73 44.4 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.758 -177.348 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.781 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -121.78 108.84 13.97 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.396 -0.82 . . . . 0.0 108.959 178.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.521 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.75 123.16 38.04 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.384 0.611 . . . . 0.0 110.534 -178.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.46 HD23 ' HB2' ' A' 3656 ' ' HIS . 57.6 mt -125.28 145.57 51.19 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.205 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -59.22 116.02 2.98 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.415 2.077 . . . . 0.0 111.814 177.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.8 p -100.73 105.32 16.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.192 0.52 . . . . 0.0 110.842 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.13 145.79 16.15 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.36 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . 0.583 ' HG2' ' HB2' ' A' 3587 ' ' ASP . 9.0 ptp85 -61.44 -32.72 72.7 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.142 0.496 . . . . 0.0 110.993 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.609 ' O ' HG23 ' A' 3588 ' ' VAL . 2.8 p-10 -152.26 -179.45 7.55 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.392 -0.822 . . . . 0.0 108.799 -178.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -49.52 -44.93 46.72 Favored 'General case' 0 C--N 1.328 -0.343 0 O-C-N 123.591 0.557 . . . . 0.0 111.479 179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -63.93 -49.12 73.85 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-O 120.823 0.344 . . . . 0.0 110.773 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.583 ' HB2' ' HG2' ' A' 3583 ' ' ARG . 15.8 t0 -62.74 -42.92 99.9 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.968 -177.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' 3584 ' ' ASP . 89.7 t -56.82 -49.35 79.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.674 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 70.9 t -62.19 -44.96 99.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.528 -179.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 32.6 t -61.06 -39.17 88.83 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.922 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . 0.476 ' HA ' ' OE1' ' A' 3591 ' ' GLN . 12.6 mm-40 -72.83 -35.59 67.31 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.576 178.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 63.9 m -61.01 -53.18 60.43 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.566 177.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.538 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 11.1 pt-20 -63.17 -38.67 92.08 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.171 -178.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.1 m -65.88 -46.52 78.1 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.926 0.393 . . . . 0.0 110.56 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.558 HD12 ' HB2' ' A' 3599 ' ' PHE . 62.1 tp -62.44 -45.89 91.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.264 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.847 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 62.7 pttt -70.1 -26.87 64.18 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.568 -0.453 . . . . 0.0 111.48 -176.076 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.55 -39.47 20.35 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.929 0.395 . . . . 0.0 111.305 178.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.458 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -89.74 -46.07 8.86 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 -172.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.558 ' HB2' HD12 ' A' 3595 ' ' LEU . 18.9 m-85 -99.37 -50.35 4.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.667 0.27 . . . . 0.0 111.619 -175.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.847 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.1 mm -62.15 -55.7 22.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.959 -176.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 90.4 m -58.04 -43.68 86.96 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.422 -0.353 . . . . 0.0 111.001 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.728 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -61.11 -56.93 15.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.895 -0.138 . . . . 0.0 110.782 177.722 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.728 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.7 -43.38 80.46 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 111.734 0.272 . . . . 0.0 111.734 -178.671 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -71.58 -38.63 70.9 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.774 0.321 . . . . 0.0 110.508 -176.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.17 -30.72 67.93 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.942 0.401 . . . . 0.0 111.062 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . 0.416 ' HG2' ' O ' ' A' 3602 ' ' TYR . 73.4 mmtt -83.18 -19.56 36.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.737 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . 0.589 ' O ' ' HG ' ' A' 3555 ' ' LEU . 28.0 mt-30 54.3 47.46 22.95 Favored 'General case' 0 C--O 1.233 0.221 0 N-CA-C 109.288 -0.634 . . . . 0.0 109.288 -170.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.575 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -127.44 179.0 5.71 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.791 -171.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.681 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -117.7 118.16 31.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.966 -1.015 . . . . 0.0 109.02 171.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . 0.458 ' N ' HD11 ' A' 3603 ' ' LEU . . . -65.45 102.76 0.71 Allowed Glycine 0 C--O 1.221 -0.672 0 C-N-CA 120.82 -0.705 . . . . 0.0 111.493 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.679 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 30.2 mm -88.88 119.89 36.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-O 121.229 0.537 . . . . 0.0 110.695 -175.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.689 HD13 ' HB3' ' A' 3547 ' ' LEU . 36.3 mt -114.86 106.53 20.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.165 176.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.447 ' HA ' ' O ' ' A' 3624 ' ' TYR . 7.7 m120 -84.49 129.06 34.89 Favored 'General case' 0 CA--C 1.512 -0.483 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.869 176.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' 3537 ' ' SER . 3.3 p -134.62 133.77 21.65 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.656 -178.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.511 ' HA ' ' O ' ' A' 3621 ' ' GLN . 74.1 Cg_endo -78.78 137.04 13.87 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.299 1.999 . . . . 0.0 112.353 175.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.711 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 11.1 t30 -67.2 121.81 80.07 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.901 179.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -48.9 121.16 6.26 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.386 2.724 . . . . 0.0 112.996 -175.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 95.28 -36.23 3.91 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.909 -0.663 . . . . 0.0 112.346 178.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 4.3 m -90.14 -28.45 18.93 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.863 0.363 . . . . 0.0 110.231 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 2.5 m-20 65.89 18.99 11.24 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.338 178.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.511 ' O ' ' HA ' ' A' 3615 ' ' PRO . 33.2 mt-30 -89.94 114.92 62.58 Favored Pre-proline 0 C--N 1.327 -0.41 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.442 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 91.9 Cg_endo -84.15 24.33 0.76 Allowed 'Trans proline' 0 CA--C 1.529 0.251 0 C-N-CA 123.406 2.737 . . . . 0.0 112.959 -175.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -79.41 37.75 0.34 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.99 0.424 . . . . 0.0 111.944 -176.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.711 ' HE2' ' HB2' ' A' 3616 ' ' ASN . 72.2 m-85 -123.9 132.86 53.81 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.084 177.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.475 HG13 HG23 ' A' 3611 ' ' ILE . 11.5 t -120.56 113.46 40.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.003 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.665 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -96.3 110.97 23.19 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 170.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.481 ' HB2' ' HB ' ' A' 3660 ' ' VAL . 44.0 mt-30 -94.1 111.9 23.66 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.205 -177.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.595 HG12 HG12 ' A' 3659 ' ' ILE . 37.1 mt -92.05 97.83 7.67 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.082 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.099 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -89.71 135.92 30.06 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.761 178.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.564 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 37.3 Cg_endo -66.38 171.02 11.1 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.819 2.346 . . . . 0.0 111.698 177.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -70.27 42.4 0.38 Allowed 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.129 2.553 . . . . 0.0 113.126 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 24.1 p -75.37 161.78 28.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.425 177.678 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -53.18 -35.73 60.14 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.516 -179.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 24.2 t80 -53.01 -48.73 67.31 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-O 120.888 0.375 . . . . 0.0 111.059 176.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 10.8 m -67.05 -52.52 41.24 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.39 -178.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -57.17 -43.56 82.69 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.676 -176.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 23.3 m -65.65 -46.35 79.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.035 0.445 . . . . 0.0 110.613 -177.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 8.0 m80 -63.69 -38.5 91.35 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.696 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 69.3 mt -65.76 -40.83 92.45 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.809 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.65 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 11.6 p -68.59 -27.09 65.74 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.841 -0.343 . . . . 0.0 110.822 -179.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.3 -47.11 13.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.986 176.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.77 HD13 HD22 ' A' 3575 ' ' LEU . 20.8 mt -77.04 -40.95 44.46 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.394 -173.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.482 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -143.09 86.7 9.06 Favored Pre-proline 0 C--N 1.327 -0.408 0 CA-C-O 120.756 0.313 . . . . 0.0 111.216 -179.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -70.37 -23.07 28.44 Favored 'Trans proline' 0 N--CA 1.463 -0.271 0 C-N-CA 122.662 2.241 . . . . 0.0 113.475 -174.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 20.0 t0 -78.37 -49.41 13.61 Favored 'General case' 0 CA--C 1.516 -0.335 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.241 -174.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.781 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -72.3 -30.48 64.83 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 179.135 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.65 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -55.78 -45.89 78.06 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.131 177.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.06 -27.69 68.53 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.035 0.445 . . . . 0.0 111.206 -178.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.672 ' HB3' HG13 ' A' 3496 ' ' VAL . 6.9 m -79.28 -39.3 33.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.705 178.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.681 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.6 pt -80.79 -11.72 12.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.293 0 CA-C-O 120.903 0.382 . . . . 0.0 111.522 -174.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 45.5 m -57.94 -26.98 62.97 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.447 175.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -87.06 -34.74 19.07 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.368 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.681 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.1 tp -104.35 40.19 0.21 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-O 122.292 1.044 . . . . 0.0 109.635 -179.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.44 ' N ' ' HD2' ' A' 3655 ' ' PRO . 49.3 m -33.38 -44.66 0.46 Allowed Pre-proline 0 CA--C 1.54 0.573 0 CA-C-N 114.113 -1.403 . . . . 0.0 113.829 169.257 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.49 ' HG2' HD12 ' A' 3653 ' ' ILE . 13.5 Cg_endo -59.53 76.12 0.05 OUTLIER 'Trans proline' 0 C--N 1.36 1.166 0 C-N-CA 121.707 1.605 . . . . 0.0 111.819 169.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . 0.46 ' HB2' HD23 ' A' 3579 ' ' LEU . 18.5 p80 -146.22 174.06 11.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.781 -176.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.506 HD22 HG22 ' A' 3628 ' ' ILE . 36.5 mt -123.33 144.96 49.11 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.482 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 55.6 ttp -107.17 110.46 22.54 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 174.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.849 HD12 HD21 ' A' 3524 ' ' LEU . 88.9 mt -101.52 115.75 43.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-O 121.433 0.635 . . . . 0.0 111.32 -173.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.778 HG13 ' HD2' ' A' 3573 ' ' TYR . 90.8 t -102.75 112.03 34.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.024 -0.989 . . . . 0.0 110.615 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.665 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.7 mt -90.38 112.57 25.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.102 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -112.18 127.46 55.95 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 120.843 0.354 . . . . 0.0 110.953 -179.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 15.1 p -94.62 109.63 21.53 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 172.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 4.2 m . . . . . 0 C--O 1.249 1.073 0 CA-C-O 117.894 -1.051 . . . . 0.0 111.256 -175.916 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.477 ' CD1' ' HB2' ' A' 3553 ' ' MET . 46.7 m-85 . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 111.483 0.179 . . . . 0.0 111.483 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.558 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.4 OUTLIER 55.37 -156.65 0.25 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 121.802 0.81 . . . . 0.0 111.879 174.495 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.434 ' H ' ' HB3' ' B' 2519 ' ' GLU . 4.2 t -153.45 127.01 8.69 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 114.321 -1.309 . . . . 0.0 107.682 167.58 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.571 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER -81.9 -127.68 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -177.307 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.676 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 13.8 t70 -169.14 -71.58 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.905 -177.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.252 -0.88 . . . . 0.0 109.431 174.253 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.75 HG13 ' HB3' ' A' 3649 ' ' SER . 45.9 t . . . . . 0 N--CA 1.477 0.924 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 29.8 t70 -104.78 120.21 40.83 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.985 0.421 . . . . 0.0 111.008 -178.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . 0.478 ' O ' HD12 ' A' 3502 ' ' LEU . 3.1 mpp? -80.77 -24.24 38.77 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.93 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.479 ' HA ' HD12 ' A' 3502 ' ' LEU . 22.1 t -65.3 -25.06 36.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.18 0.514 . . . . 0.0 111.123 -174.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -77.35 -56.77 4.26 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.104 0.478 . . . . 0.0 110.76 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.524 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp -70.04 -32.33 70.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -170.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.605 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -71.2 -15.71 62.48 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 120.034 -0.666 . . . . 0.0 110.177 -174.786 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.605 ' N ' HD13 ' A' 3502 ' ' LEU . 52.3 tptt -71.04 -18.31 62.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 121.494 0.664 . . . . 0.0 109.46 177.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.44 ' HB3' ' CE2' ' A' 3505 ' ' TYR . 29.2 mmtp -104.91 -44.65 4.77 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.92 174.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.697 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -151.87 105.6 2.85 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.553 -177.671 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . 0.466 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 88.7 Cg_endo -83.69 173.73 9.19 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.952 3.101 . . . . 0.0 113.655 -175.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.59 HG12 ' CD2' ' A' 3525 ' ' HIS . 61.3 mt -71.56 132.03 33.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.524 -179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.477 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.3 m -100.38 -31.34 3.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.587 -178.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.597 ' HB2' HD13 ' A' 3538 ' ' LEU . 51.4 t-105 -148.59 155.13 40.7 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 110.521 -177.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 35.3 tt0 -149.02 120.04 7.69 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 108.893 -0.781 . . . . 0.0 108.893 176.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -169.58 -127.34 0.92 Allowed Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.157 -0.777 . . . . 0.0 111.157 -178.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.649 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.2 mp -141.37 153.91 45.35 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.005 0.431 . . . . 0.0 110.82 178.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.485 HD23 ' HB2' ' A' 3547 ' ' LEU . 98.2 mt -107.78 150.83 26.51 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 169.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.746 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -147.83 124.5 11.13 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.779 0.323 . . . . 0.0 111.608 -178.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.603 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -136.41 139.58 42.55 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 174.256 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.749 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.0 OUTLIER 62.49 -95.26 0.05 OUTLIER 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 -167.634 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 14.0 m120 -140.16 6.6 2.16 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.144 -0.935 . . . . 0.0 109.188 176.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.503 ' O ' ' HA ' ' A' 3514 ' ' ALA . 11.9 m-20 -91.22 127.86 36.82 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.366 -174.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.534 HG22 ' HB2' ' A' 3514 ' ' ALA . 40.4 p -119.89 145.3 46.82 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.936 0.398 . . . . 0.0 111.627 -178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -142.87 120.16 11.56 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 174.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.645 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.93 118.6 16.07 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 120.964 0.412 . . . . 0.0 109.937 179.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.433 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 33.5 m -126.55 147.59 31.39 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 121.725 0.774 . . . . 0.0 112.525 -174.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -106.24 125.31 50.83 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 114.411 -1.268 . . . . 0.0 108.614 171.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.89 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -96.16 106.43 18.62 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-O 121.42 0.629 . . . . 0.0 111.176 -177.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.59 ' CD2' HG12 ' A' 3507 ' ' ILE . 29.1 m170 -82.96 138.79 33.67 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.407 176.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.697 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.8 t80 -68.93 137.28 53.68 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 174.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.578 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.3 t -114.66 -56.52 4.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.814 0 CA-C-O 121.447 0.641 . . . . 0.0 110.871 177.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.419 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 37.6 m -162.87 171.88 15.98 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.091 -171.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.61 -155.12 26.59 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.4 -0.905 . . . . 0.0 112.348 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . . . . . . . . . 39.2 t30 -100.18 113.82 26.77 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.619 0.247 . . . . 0.0 110.77 -178.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -64.12 -27.84 69.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.461 -177.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 49.4 t -60.33 -33.09 52.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.865 0.364 . . . . 0.0 110.362 178.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.476 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 23.0 mt -60.15 -39.76 87.49 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.968 178.041 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.489 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -67.54 -41.36 84.41 Favored 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.542 179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 32.3 t60 -64.33 -35.0 79.45 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.895 0.379 . . . . 0.0 110.723 -179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.45 ' HD3' HD23 ' A' 3533 ' ' LEU . 13.3 ptm180 -89.25 -8.99 52.36 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -177.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.449 ' O ' HG21 ' A' 3614 ' ' VAL . 34.0 p -104.87 -39.89 6.13 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.557 177.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.597 HD13 ' HB2' ' A' 3509 ' ' TRP . 26.0 mt -80.69 109.34 12.75 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.039 0.447 . . . . 0.0 109.911 -174.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . 0.451 ' HD3' HG21 ' A' 3614 ' ' VAL . 61.1 Cg_endo -78.61 149.92 24.19 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 122.995 2.464 . . . . 0.0 113.057 -172.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.403 ' HB3' ' CH2' ' A' 3509 ' ' TRP . 1.0 OUTLIER -157.41 162.26 38.99 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.162 176.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 22.9 t -176.85 -45.09 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -143.31 114.54 7.88 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.145 178.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 68.03 -102.53 0.86 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.003 -178.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -169.46 102.66 0.18 Allowed Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 111.569 -0.612 . . . . 0.0 111.569 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -66.76 142.98 65.61 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 122.788 2.325 . . . . 0.0 112.605 -177.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.649 ' HA ' ' O ' ' A' 3512 ' ' LEU . 74.0 Cg_endo -79.64 123.09 5.21 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 122.51 2.14 . . . . 0.0 112.632 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.782 ' HB3' HD13 ' A' 3612 ' ' ILE . 55.3 mt -69.18 120.07 14.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.033 176.587 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.746 ' HA ' ' O ' ' A' 3514 ' ' ALA . 14.3 ptt180 -93.7 141.14 28.82 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.838 0.351 . . . . 0.0 111.285 -176.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.666 ' CG2' HD23 ' B' 2521 ' ' LEU . 25.2 mt -99.03 106.19 18.52 Favored 'Isoleucine or valine' 0 C--O 1.245 0.84 0 CA-C-O 121.922 0.867 . . . . 0.0 111.075 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.487 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.03 0.06 14.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.607 -174.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.642 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 23.1 mt-30 -148.55 175.31 11.27 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.514 178.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.806 ' HD3' ' HB2' ' B' 2521 ' ' LEU . 0.0 OUTLIER -159.85 140.11 11.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.728 0.299 . . . . 0.0 111.752 -177.182 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.582 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -110.86 120.46 42.46 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.482 -0.327 . . . . 0.0 110.226 177.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' 3554 ' ' ARG . 14.8 mmt180 -68.44 109.52 3.73 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.521 ' O ' HD12 ' A' 3555 ' ' LEU . 2.4 pp -71.56 98.3 1.85 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 122.209 1.004 . . . . 0.0 109.623 -177.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.518 ' O ' ' HG ' ' A' 3560 ' ' LEU . 36.3 mt-10 -108.87 164.72 12.14 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.621 -1.172 . . . . 0.0 109.026 178.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.634 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.16 -50.46 66.94 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.015 0.436 . . . . 0.0 110.214 179.183 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 3.0 p -60.5 -40.76 92.52 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.617 178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.527 ' O ' HG23 ' A' 3563 ' ' VAL . 15.2 mm-40 -63.36 -50.1 71.28 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.697 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' 3556 ' ' GLU . 85.0 mt -61.13 -31.88 71.59 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.297 -176.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.634 ' HG2' ' O ' ' A' 3557 ' ' ALA . 18.3 mm-40 -60.74 -50.85 71.82 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.226 0.536 . . . . 0.0 109.754 174.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . 0.409 ' HA2' ' HD2' ' A' 3565 ' ' ARG . . . -63.87 -39.64 97.56 Favored Glycine 0 N--CA 1.45 -0.421 0 CA-C-N 115.167 -0.924 . . . . 0.0 112.168 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.556 ' O ' ' HG3' ' A' 3567 ' ' MET . 90.4 t -60.24 -48.54 87.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-O 120.59 0.234 . . . . 0.0 110.782 177.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.66 -30.35 68.68 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.574 -178.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.518 ' HG3' ' O ' ' A' 3561 ' ' GLU . 99.7 mtt180 -57.64 -42.36 83.27 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.528 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . 0.419 ' HG2' ' O ' ' A' 3563 ' ' VAL . 11.5 ptp180 -87.06 -13.59 43.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.949 0.404 . . . . 0.0 110.604 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.556 ' HG3' ' O ' ' A' 3563 ' ' VAL . 85.6 mtp -79.53 -26.54 41.44 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.988 0.423 . . . . 0.0 110.593 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 15.1 t -85.0 1.37 47.9 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.188 0.518 . . . . 0.0 110.065 177.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 40.9 t -116.7 84.32 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.489 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.785 176.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -72.8 108.49 5.79 Favored 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 -179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . . . . . . . . . 1.5 m 155.38 -43.52 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 O-C-N 124.998 1.436 . . . . 0.0 108.059 -173.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -86.65 -27.29 23.88 Favored 'General case' 0 CA--C 1.514 -0.406 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.968 -177.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.771 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -129.41 162.08 28.87 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 120.63 -0.428 . . . . 0.0 109.939 178.215 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.625 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 48.8 t -124.41 136.91 54.43 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 170.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.791 HD22 HD13 ' A' 3642 ' ' LEU . 14.6 tp -105.85 125.44 50.99 Favored 'General case' 0 C--N 1.311 -1.096 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 179.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.634 HD11 HD11 ' A' 3661 ' ' ILE . 82.3 mt -127.11 153.21 46.3 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.111 0.481 . . . . 0.0 110.725 -177.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.644 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.44 107.15 12.54 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.609 -0.723 . . . . 0.0 109.15 -179.538 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.465 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 124.01 38.16 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.416 0.627 . . . . 0.0 110.473 -177.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.476 HD23 ' HB2' ' A' 3656 ' ' HIS . 84.8 mt -125.42 146.31 53.97 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.155 -178.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -59.32 117.04 3.72 Favored 'Trans proline' 0 CA--C 1.532 0.381 0 C-N-CA 122.195 1.93 . . . . 0.0 111.88 176.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.2 p -107.21 106.7 17.29 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.286 0.565 . . . . 0.0 110.579 -179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . 0.405 ' H ' HG22 ' A' 3588 ' ' VAL . . . -103.61 147.13 16.62 Favored Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 115.622 -0.717 . . . . 0.0 112.265 -179.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . 0.423 ' HG2' ' CB ' ' A' 3587 ' ' ASP . 35.5 ptt180 -59.01 -35.03 72.56 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.254 0.55 . . . . 0.0 111.115 177.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.573 ' O ' HG23 ' A' 3588 ' ' VAL . 10.3 t70 -142.84 174.19 10.88 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 178.233 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -55.93 -33.86 65.09 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 118.613 0.642 . . . . 0.0 109.916 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . 0.407 ' HG3' ' H ' ' A' 3586 ' ' GLU . 20.1 mt-10 -56.49 -54.68 42.93 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.379 175.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.502 ' O ' ' HG2' ' A' 3591 ' ' GLN . 3.1 t70 -65.84 -36.04 82.35 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.718 -178.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.573 HG23 ' O ' ' A' 3584 ' ' ASP . 99.2 t -57.49 -48.03 83.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.299 178.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 65.9 t -60.19 -44.06 94.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.02 177.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 43.7 t -60.7 -46.59 89.82 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.153 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' 3587 ' ' ASP . 70.9 mm-40 -65.15 -41.48 94.69 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 178.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 59.5 m -59.63 -53.28 59.83 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.959 -179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -64.39 -36.97 85.89 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.584 -0.28 . . . . 0.0 111.08 -177.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 46.1 m -67.37 -44.52 78.75 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.883 0.373 . . . . 0.0 110.398 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.554 HD12 ' HB2' ' A' 3599 ' ' PHE . 46.5 tp -65.11 -46.4 81.19 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.983 -179.128 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.772 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.93 -31.06 71.77 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 121.009 -0.276 . . . . 0.0 111.084 -176.989 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.09 -42.26 17.63 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.674 0.274 . . . . 0.0 111.363 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.4 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -88.16 -45.67 9.92 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.853 0.686 . . . . 0.0 112.853 -170.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.554 ' HB2' HD12 ' A' 3595 ' ' LEU . 14.3 m-85 -99.48 -50.27 4.15 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.766 0.317 . . . . 0.0 111.245 -176.293 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.772 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 26.0 mm -61.56 -60.04 3.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.217 -175.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 88.8 m -59.08 -32.09 69.47 Favored 'General case' 0 C--N 1.329 -0.299 0 O-C-N 123.185 0.303 . . . . 0.0 111.238 -179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 42.1 t80 -77.09 -57.04 4.06 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.569 -177.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.554 HD12 ' O ' ' A' 3608 ' ' ALA . 0.4 OUTLIER -55.97 -38.62 70.64 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.235 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -73.39 -32.82 64.68 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.859 -0.337 . . . . 0.0 110.168 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -64.97 -39.48 93.54 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-O 121.209 0.528 . . . . 0.0 110.689 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.0 mmtt -81.38 -16.82 51.1 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.057 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . 0.418 ' O ' ' HG ' ' A' 3555 ' ' LEU . 55.1 mt-30 53.22 49.58 19.59 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -169.478 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.554 ' O ' HD12 ' A' 3603 ' ' LEU . . . -131.12 -178.78 4.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.334 0.588 . . . . 0.0 112.373 -171.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.752 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.81 118.35 30.59 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.572 176.112 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . 0.419 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.61 104.84 0.92 Allowed Glycine 0 C--O 1.222 -0.594 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.562 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.642 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 36.4 mm -89.6 121.67 40.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 121.207 0.527 . . . . 0.0 111.066 -175.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.782 HD13 ' HB3' ' A' 3547 ' ' LEU . 19.3 mt -117.07 113.01 41.54 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.92 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.024 177.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.443 ' HA ' ' O ' ' A' 3624 ' ' TYR . 38.1 m-80 -92.09 108.01 19.63 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.445 -179.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.451 HG21 ' HD3' ' A' 3539 ' ' PRO . 7.2 p -120.16 138.62 27.33 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.635 -171.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.716 ' HB2' ' HA ' ' A' 3620 ' ' ASN . 74.9 Cg_endo -81.73 141.51 12.25 Favored 'Trans proline' 0 N--CA 1.456 -0.734 0 C-N-CA 122.556 2.17 . . . . 0.0 112.097 173.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.554 ' OD1' ' HB3' ' A' 3619 ' ' SER . 10.9 p30 -72.17 131.61 85.07 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-O 120.996 0.427 . . . . 0.0 111.064 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -54.51 122.78 12.17 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.899 2.399 . . . . 0.0 112.45 -178.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 107.51 -42.56 1.9 Allowed Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 121.088 -0.577 . . . . 0.0 112.706 179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . 0.554 ' HB3' ' OD1' ' A' 3616 ' ' ASN . 12.6 t -106.03 -28.96 10.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.73 0.3 . . . . 0.0 110.63 -176.108 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . 0.716 ' HA ' ' HB2' ' A' 3615 ' ' PRO . 3.6 m-20 66.32 30.42 8.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.372 179.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.558 ' O ' ' HA ' ' A' 3615 ' ' PRO . 97.8 mt-30 -83.62 112.97 43.97 Favored Pre-proline 0 C--N 1.327 -0.412 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 173.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 89.6 Cg_endo -83.55 23.62 0.81 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.062 2.508 . . . . 0.0 113.453 -173.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -82.34 49.48 1.44 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.575 -177.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.443 ' O ' ' HA ' ' A' 3613 ' ' ASN . 82.7 m-85 -135.8 134.16 38.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.891 0.377 . . . . 0.0 110.726 179.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.423 HG13 HD12 ' A' 3611 ' ' ILE . 4.4 t -118.76 113.92 43.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.287 178.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.624 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.9 mp -97.83 115.53 28.24 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 169.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.56 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 44.0 mt-30 -94.72 111.44 23.22 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.702 179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.599 HG12 HG12 ' A' 3659 ' ' ILE . 38.7 mt -90.16 98.59 8.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.254 178.696 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -86.83 139.72 33.05 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.096 178.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -67.94 172.81 10.19 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 122.695 2.263 . . . . 0.0 111.52 176.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -71.21 43.59 0.5 Allowed 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 122.892 2.395 . . . . 0.0 112.58 176.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 24.5 p -74.82 162.84 28.29 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.591 -0.732 . . . . 0.0 110.767 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -52.25 -40.75 62.11 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.202 -178.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 31.3 t80 -50.43 -44.65 55.42 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 115.888 -0.596 . . . . 0.0 111.122 176.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.5 m -67.54 -56.92 7.58 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.655 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 47.9 mm-40 -57.11 -41.42 78.93 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 116.323 -0.399 . . . . 0.0 112.056 -175.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 12.0 p -66.83 -47.23 72.65 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.913 0.387 . . . . 0.0 110.869 -177.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 22.4 m-70 -66.9 -36.99 83.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.508 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 77.5 mt -61.89 -35.85 79.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.72 0.295 . . . . 0.0 110.819 176.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.876 ' HA ' HD22 ' A' 3647 ' ' LEU . 38.2 t -63.4 -37.77 88.58 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.182 0.515 . . . . 0.0 110.491 177.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . 0.594 ' NE ' ' HA ' ' A' 3641 ' ' ARG . 1.7 mmp_? -80.44 -32.23 37.34 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.955 -0.566 . . . . 0.0 112.011 -179.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.791 HD13 HD22 ' A' 3575 ' ' LEU . 32.8 mt -96.63 -27.15 14.94 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -171.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.432 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -159.32 79.69 2.76 Favored Pre-proline 0 C--N 1.329 -0.287 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -178.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . 0.514 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 3.0 Cg_exo -73.75 -18.75 21.83 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.635 2.224 . . . . 0.0 111.546 178.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . 0.483 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 6.9 m-20 -69.52 -49.91 50.05 Favored 'General case' 0 CA--C 1.513 -0.469 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.123 -178.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.644 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -82.71 -25.01 33.35 Favored 'General case' 0 N--CA 1.444 -0.766 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.278 179.147 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.876 HD22 ' HA ' ' A' 3640 ' ' SER . 34.8 tp -52.6 -49.69 64.53 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.581 178.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.52 -18.47 59.29 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.009 0.433 . . . . 0.0 111.632 -177.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.75 ' HB3' HG13 ' A' 3496 ' ' VAL . 15.5 m -87.33 -38.26 16.39 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.59 178.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.61 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.0 pt -78.72 -21.76 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -175.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 47.2 m -52.39 -30.31 28.4 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-O 120.765 0.317 . . . . 0.0 111.326 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 43.3 t-20 -82.96 -42.86 17.11 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.951 0.405 . . . . 0.0 109.954 176.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.61 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.6 tp -96.88 39.07 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-O 122.76 1.267 . . . . 0.0 109.168 -178.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.492 ' N ' ' HD2' ' A' 3655 ' ' PRO . 4.3 p -40.41 -37.26 0.84 Allowed Pre-proline 0 CA--C 1.545 0.766 0 CA-C-N 113.449 -1.705 . . . . 0.0 114.961 174.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' 3654 ' ' SER . 22.9 Cg_endo -63.89 74.07 0.17 Allowed 'Trans proline' 0 C--N 1.358 1.038 0 CA-C-N 121.053 1.412 . . . . 0.0 111.529 170.13 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . 0.476 ' HB2' HD23 ' A' 3579 ' ' LEU . 18.1 p80 -139.36 173.78 11.19 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.323 -175.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.473 HD22 HG22 ' A' 3628 ' ' ILE . 32.3 mt -121.69 148.46 44.57 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.33 178.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.3 ttp -111.21 107.89 17.36 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 174.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.89 HD12 HD21 ' A' 3524 ' ' LEU . 74.9 mt -100.91 117.26 45.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.285 0.564 . . . . 0.0 111.524 -171.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.771 HG13 ' HD2' ' A' 3573 ' ' TYR . 56.5 t -101.76 115.93 44.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.147 -178.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.634 HD11 HD11 ' A' 3576 ' ' LEU . 68.0 mt -90.34 113.12 25.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 177.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -108.94 127.34 53.98 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.914 0.388 . . . . 0.0 110.851 -178.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 32.0 t -93.47 136.4 33.78 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.69 176.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 5.1 m . . . . . 0 C--O 1.246 0.907 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.453 179.739 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.582 ' CD1' ' HB2' ' A' 3553 ' ' MET . 11.8 m-85 . . . . . 0 N--CA 1.483 1.207 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.634 ' HG2' ' H ' ' B' 2520 ' ' THR . 35.6 tt0 57.85 -163.34 0.2 Allowed 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 174.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.634 ' H ' ' HG2' ' B' 2519 ' ' GLU . 41.3 m -150.56 124.23 9.13 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.806 ' HB2' ' HD3' ' A' 3552 ' ' ARG . 7.1 tp -90.35 -126.17 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.404 -0.518 . . . . 0.0 110.463 -179.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.749 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 4.2 t70 -165.57 -66.77 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.656 -177.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 . . . . . 0 C--O 1.248 0.981 0 CA-C-O 118.717 -0.659 . . . . 0.0 110.054 -175.824 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.688 HG13 ' HB3' ' A' 3649 ' ' SER . 47.6 t . . . . . 0 N--CA 1.479 1.01 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 37.7 t70 -95.42 111.58 23.44 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.024 0.44 . . . . 0.0 110.198 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . 0.691 ' HG2' ' HB3' ' A' 3502 ' ' LEU . 51.5 ttp -80.95 -18.33 47.42 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.228 -176.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.413 ' HA ' HD12 ' A' 3502 ' ' LEU . 35.6 t -57.19 -24.69 21.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.303 0.573 . . . . 0.0 110.877 -178.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -78.12 -60.28 2.44 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.298 0.57 . . . . 0.0 110.566 173.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.54 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.0 pp -71.34 -31.48 67.43 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -170.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.691 ' HB3' ' HG2' ' A' 3498 ' ' MET . 0.0 OUTLIER -67.48 -16.96 64.5 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 118.677 0.671 . . . . 0.0 110.278 -175.327 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.652 ' N ' HD13 ' A' 3502 ' ' LEU . 56.0 tptt -66.42 -25.8 66.92 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 121.358 0.599 . . . . 0.0 109.385 177.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' 3504 ' ' LYS . 61.1 mmtt -105.58 -42.23 5.26 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.992 177.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.637 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.19 105.64 3.16 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-O 121.503 0.668 . . . . 0.0 111.521 -177.657 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -82.86 175.34 8.74 Favored 'Trans proline' 0 CA--C 1.533 0.43 0 C-N-CA 124.24 3.293 . . . . 0.0 113.248 178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.487 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 90.9 mt -70.78 132.85 32.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.136 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.565 HG13 ' HB2' ' A' 3526 ' ' PHE . 29.2 m -100.76 -26.39 3.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.189 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.666 ' CZ2' ' HA3' ' A' 3544 ' ' GLY . 43.2 t-105 -154.89 156.37 36.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.882 0.372 . . . . 0.0 110.779 -178.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . 0.436 HE21 ' HB3' ' A' 3510 ' ' GLN . 0.9 OUTLIER -151.29 119.22 6.21 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 176.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.74 -131.05 1.29 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.485 -0.646 . . . . 0.0 111.485 -176.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.637 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -140.55 150.38 43.61 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.217 0.532 . . . . 0.0 111.569 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.46 HD23 ' HB2' ' A' 3547 ' ' LEU . 83.1 mt -105.55 154.02 20.96 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 170.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.718 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -148.72 126.53 11.86 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 120.896 -0.322 . . . . 0.0 111.491 -179.421 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.689 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.68 140.62 38.88 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 172.549 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.812 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.4 OUTLIER 62.52 -93.0 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -169.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 8.8 m120 -143.36 11.34 1.71 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 171.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.537 ' HB3' ' HB1' ' A' 3598 ' ' ALA . 27.9 m-20 -88.03 116.98 26.59 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.152 -176.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 21.8 p -110.54 133.42 53.31 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.91 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . 1.009 ' HB1' HE22 ' A' 3591 ' ' GLN . . . -135.11 120.1 18.63 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.379 177.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.637 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.93 117.76 16.09 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.209 0.528 . . . . 0.0 110.493 178.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.423 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 28.9 m -127.95 147.48 32.61 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.725 0.774 . . . . 0.0 112.126 -175.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 22.3 pt20 -105.71 125.81 51.42 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.937 173.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.843 HD21 HD12 ' A' 3659 ' ' ILE . 2.0 mt -97.06 105.96 18.21 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-O 121.498 0.666 . . . . 0.0 111.573 -176.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.487 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 26.0 m-70 -86.26 138.9 31.5 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.922 -1.035 . . . . 0.0 108.695 176.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.637 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.7 t80 -68.57 139.32 55.56 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.556 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.8 t -114.83 -55.67 4.31 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.873 0 CA-C-O 121.298 0.57 . . . . 0.0 110.994 177.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 58.5 m -163.75 170.76 16.5 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.276 -172.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 87.87 -150.96 22.66 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.668 -0.777 . . . . 0.0 113.483 174.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.532 ' HB2' ' HA ' ' A' 3571 ' ' THR . 53.8 t-20 -93.45 107.74 19.53 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.342 -0.429 . . . . 0.0 110.553 -175.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -64.06 -30.82 71.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.634 0.254 . . . . 0.0 110.947 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 45.0 t -64.22 -31.57 53.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 120.955 0.407 . . . . 0.0 110.007 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.513 HD12 ' HB3' ' A' 3530 ' ' ASN . 16.6 mt -59.39 -40.2 85.81 Favored 'General case' 0 C--O 1.222 -0.374 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.774 176.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.408 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.87 -39.35 87.51 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.909 0.385 . . . . 0.0 110.267 179.579 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -61.35 -40.18 93.33 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.934 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -89.43 -10.13 47.62 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -176.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.652 ' O ' HG11 ' A' 3614 ' ' VAL . 77.5 p -103.87 -37.15 7.54 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.932 0.396 . . . . 0.0 111.416 -179.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.64 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.1 mt -81.85 111.35 25.82 Favored Pre-proline 0 C--N 1.318 -0.783 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -65.93 131.83 28.42 Favored 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.439 2.093 . . . . 0.0 112.985 -174.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.427 ' O ' ' HB2' ' A' 3541 ' ' SER . 3.7 pp -156.2 152.74 28.2 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.131 179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' 3540 ' ' LEU . 38.9 t 169.64 -42.33 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.549 0.69 . . . . 0.0 109.228 -175.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -127.15 -8.11 5.92 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.241 -0.891 . . . . 0.0 111.32 -174.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 157.31 -27.66 0.49 Allowed Glycine 0 N--CA 1.444 -0.79 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.246 -177.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . 0.666 ' HA3' ' CZ2' ' A' 3509 ' ' TRP . . . 96.34 97.16 1.83 Allowed Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.453 177.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -62.71 147.23 94.99 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.863 2.376 . . . . 0.0 111.961 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.401 ' HA ' ' O ' ' A' 3512 ' ' LEU . 22.0 Cg_endo -62.04 134.84 51.67 Favored 'Trans proline' 0 N--CA 1.462 -0.366 0 C-N-CA 122.591 2.194 . . . . 0.0 112.428 -179.262 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.708 ' HB3' HD13 ' A' 3612 ' ' ILE . 65.4 mt -69.29 109.51 4.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.175 178.16 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.718 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.1 OUTLIER -90.51 134.82 34.1 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.879 0.371 . . . . 0.0 110.513 -177.784 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.515 HG12 HD11 ' A' 3612 ' ' ILE . 16.9 mt -90.52 107.29 18.3 Favored 'Isoleucine or valine' 0 C--O 1.248 0.997 0 CA-C-O 122.401 1.096 . . . . 0.0 111.061 -177.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.617 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -119.81 10.61 11.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.657 -1.156 . . . . 0.0 111.425 -174.325 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.788 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 32.1 mt-30 -154.49 167.68 29.26 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.832 -0.167 . . . . 0.0 110.558 179.316 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.41 143.27 14.85 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 120.869 0.366 . . . . 0.0 111.785 -177.221 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.539 ' O ' ' HA ' ' A' 3608 ' ' ALA . 12.4 tmm? -119.09 134.72 55.03 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.304 178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? -70.81 109.67 5.13 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.124 -0.324 . . . . 0.0 110.124 -179.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.615 ' O ' HD12 ' A' 3555 ' ' LEU . 2.6 pp -74.57 98.23 3.33 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.115 0.96 . . . . 0.0 109.801 -179.352 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.49 ' H ' ' HB2' ' A' 3559 ' ' GLN . 19.1 mm-40 -116.36 172.15 7.38 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.296 177.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -57.79 -51.62 68.81 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.693 0.282 . . . . 0.0 111.268 -176.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 60.1 p -71.11 -37.22 72.36 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.162 -178.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.492 ' O ' HG23 ' A' 3563 ' ' VAL . 11.7 mm-40 -63.69 -49.51 72.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.536 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . . . . . . . . . 83.9 mt -62.09 -35.79 79.72 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.029 -179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -66.65 -44.16 82.65 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.053 0.454 . . . . 0.0 110.586 174.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -52.53 -42.12 57.27 Favored Glycine 0 CA--C 1.518 0.254 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.993 173.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.521 ' O ' ' HG3' ' A' 3567 ' ' MET . 42.7 t -65.82 -49.6 76.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 174.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . 0.574 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.08 -27.2 63.44 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.817 -178.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.545 ' O ' HG22 ' A' 3568 ' ' THR . 0.0 OUTLIER -58.57 -45.57 88.74 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.88 177.443 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -87.79 -4.44 58.88 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.074 0.464 . . . . 0.0 110.711 178.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.574 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 87.6 mtp -85.94 -15.88 40.21 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.141 178.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . 0.545 HG22 ' O ' ' A' 3565 ' ' ARG . 11.6 t -85.95 3.13 43.39 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.11 0.481 . . . . 0.0 110.32 179.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 20.6 t -117.48 89.61 1.39 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.473 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.14 110.31 3.93 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.532 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.5 m 142.24 -42.97 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.774 1.629 . . . . 0.0 108.279 -177.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -79.24 -31.16 43.5 Favored 'General case' 0 CA--C 1.517 -0.317 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.092 179.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.691 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -129.85 167.44 18.14 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.36 -0.382 . . . . 0.0 109.988 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.654 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 49.8 t -128.16 137.15 51.95 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 172.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.813 HD22 HD13 ' A' 3642 ' ' LEU . 14.1 tp -106.98 125.97 51.7 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 109.368 -0.605 . . . . 0.0 109.368 178.593 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.592 HD11 HD11 ' A' 3661 ' ' ILE . 75.6 mt -127.41 152.42 47.54 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.04 0.448 . . . . 0.0 110.911 -177.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.652 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.35 107.55 13.07 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.52 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.66 119.2 32.93 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.376 0.608 . . . . 0.0 110.339 -178.258 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.437 ' HG ' HD12 ' A' 3577 ' ' LEU . 48.2 mt -117.19 147.92 41.37 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 114.654 -1.157 . . . . 0.0 110.251 -179.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . 0.457 ' HG2' HD11 ' A' 3653 ' ' ILE . 19.3 Cg_endo -60.45 123.06 12.3 Favored 'Trans proline' 0 CA--C 1.531 0.325 0 C-N-CA 122.234 1.956 . . . . 0.0 111.932 175.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.8 p -117.0 116.53 27.55 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.465 0.65 . . . . 0.0 110.887 179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . 0.518 ' H ' HG22 ' A' 3588 ' ' VAL . . . -103.66 146.77 16.5 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.948 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 2.6 mmp_? -62.78 -36.22 82.39 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.594 0.711 . . . . 0.0 109.226 178.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.6 ' O ' HG23 ' A' 3588 ' ' VAL . 16.9 t70 -131.23 166.17 21.75 Favored 'General case' 0 N--CA 1.443 -0.777 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 -179.638 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -55.85 -39.12 70.99 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.833 0.349 . . . . 0.0 110.648 179.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -66.42 -42.5 87.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.998 0.427 . . . . 0.0 110.37 177.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.484 ' HB3' ' H ' ' A' 3584 ' ' ASP . 24.1 t70 -61.42 -38.52 87.44 Favored 'General case' 0 CA--C 1.514 -0.415 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.152 178.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' 3584 ' ' ASP . 78.9 t -56.33 -47.41 81.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.44 176.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 83.0 t -59.42 -47.43 90.72 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.324 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 36.1 t -60.65 -45.5 93.86 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.162 -179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . 1.009 HE22 ' HB1' ' A' 3520 ' ' ALA . 25.9 tp60 -67.56 -41.58 83.98 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.826 179.517 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . 0.514 ' O ' ' HG3' ' A' 3596 ' ' LYS . 87.7 m -57.6 -52.37 65.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.516 0.198 . . . . 0.0 110.991 179.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.549 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 12.2 pt-20 -65.13 -31.13 72.16 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 120.759 0.314 . . . . 0.0 111.32 -178.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 48.9 m -68.71 -48.62 63.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.848 0.356 . . . . 0.0 110.38 177.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.621 HD12 ' HB2' ' A' 3599 ' ' PHE . 55.9 tp -62.19 -41.89 98.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.843 -179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.549 ' HE2' ' HA ' ' A' 3593 ' ' GLU . 53.4 mtmt -57.77 -48.16 80.46 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.008 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -75.85 -39.57 56.33 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.537 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -86.97 -46.77 9.54 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -169.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.621 ' HB2' HD12 ' A' 3595 ' ' LEU . 17.4 m-85 -99.51 -50.45 4.08 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.818 0.342 . . . . 0.0 111.283 -177.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.538 ' HB ' ' O ' ' A' 3596 ' ' LYS . 31.1 mm -61.07 -55.84 21.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.69 -175.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 48.0 m -60.48 -45.94 91.92 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.248 -179.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.725 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -60.14 -52.28 66.0 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.724 0.297 . . . . 0.0 110.648 179.193 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.725 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -67.78 -34.1 76.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.785 0.326 . . . . 0.0 110.833 -170.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -76.62 -38.89 53.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.139 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.94 -41.12 78.49 Favored 'General case' 0 CA--C 1.522 -0.125 0 CA-C-O 120.804 0.335 . . . . 0.0 110.936 -179.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 27.6 mmmt -78.32 -10.45 59.68 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.395 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . 0.411 ' O ' ' HG ' ' A' 3555 ' ' LEU . 43.0 mt-30 55.17 47.93 20.64 Favored 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.334 0.396 . . . . 0.0 111.017 178.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.539 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -133.88 171.43 14.19 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -171.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -104.4 117.82 35.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.685 -1.143 . . . . 0.0 109.213 170.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -67.78 104.37 1.15 Allowed Glycine 0 C--O 1.222 -0.598 0 C-N-CA 120.636 -0.793 . . . . 0.0 111.702 179.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.788 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 31.9 mm -90.38 131.24 38.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 121.073 0.463 . . . . 0.0 111.14 -174.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.708 HD13 ' HB3' ' A' 3547 ' ' LEU . 55.3 mt -131.46 108.83 15.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.039 178.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.688 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.0 m120 -81.06 136.47 35.96 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.25 0.547 . . . . 0.0 111.033 178.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.652 HG11 ' O ' ' A' 3537 ' ' SER . 21.3 t -128.55 136.21 28.77 Favored Pre-proline 0 C--N 1.324 -0.533 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.807 -177.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.523 ' HA ' ' O ' ' A' 3621 ' ' GLN . 96.9 Cg_endo -83.46 135.82 7.26 Favored 'Trans proline' 0 N--CA 1.453 -0.885 0 C-N-CA 122.199 1.933 . . . . 0.0 112.091 171.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.645 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 26.4 t-20 -67.8 129.16 93.4 Favored Pre-proline 0 C--N 1.321 -0.652 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.409 -179.636 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -57.08 108.07 0.33 Allowed 'Trans proline' 0 CA--C 1.53 0.282 0 C-N-CA 122.844 2.363 . . . . 0.0 112.702 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 107.32 -33.56 6.29 Favored Glycine 0 N--CA 1.449 -0.477 0 C-N-CA 121.128 -0.558 . . . . 0.0 112.088 178.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . 0.419 ' HB3' ' HB3' ' A' 3616 ' ' ASN . 30.9 t -95.89 -30.08 13.84 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.838 0.352 . . . . 0.0 110.45 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 65.4 t30 67.14 12.44 8.96 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.417 -177.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.549 ' HG2' ' H ' ' A' 3623 ' ' ALA . 28.0 tt0 -68.82 110.66 6.37 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.451 177.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.467 ' HA ' ' O ' ' A' 3614 ' ' VAL . 88.8 Cg_endo -84.1 22.96 0.87 Allowed 'Trans proline' 0 N--CA 1.462 -0.359 0 C-N-CA 122.734 2.289 . . . . 0.0 112.506 -177.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . 0.549 ' H ' ' HG2' ' A' 3621 ' ' GLN . . . -83.26 46.95 1.18 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.296 -177.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.688 ' O ' ' HA ' ' A' 3613 ' ' ASN . 62.0 m-85 -127.06 133.54 50.45 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.132 175.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.459 HG13 HG23 ' A' 3611 ' ' ILE . 3.8 t -125.2 113.71 36.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.837 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.003 177.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.636 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -96.74 112.19 24.05 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 169.576 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . . . . . . . . . 7.3 mt-30 -94.51 110.57 22.36 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 -178.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.594 HG12 HG12 ' A' 3659 ' ' ILE . 32.9 mt -90.98 99.26 9.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.993 179.527 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . 0.444 ' CE1' ' HB2' ' A' 3609 ' ' ALA . 78.3 m-85 -89.83 138.44 27.88 Favored Pre-proline 0 C--N 1.318 -0.778 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.12 178.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.597 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 36.4 Cg_endo -65.53 169.57 12.49 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.556 2.171 . . . . 0.0 111.113 175.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.0 53.45 1.53 Allowed 'Trans proline' 0 CA--C 1.534 0.508 0 C-N-CA 122.703 2.269 . . . . 0.0 112.51 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 26.0 p -81.03 162.63 23.71 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.429 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -52.2 -41.06 62.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.542 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 26.4 t80 -57.46 -44.73 85.03 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.867 179.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 14.6 m -61.58 -58.47 7.98 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.77 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -60.16 -37.87 81.47 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.465 -174.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 39.6 m -66.81 -49.97 64.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.838 0.352 . . . . 0.0 110.74 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 12.4 m-70 -65.38 -32.63 74.37 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.554 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 50.8 mt -63.5 -35.19 79.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.365 177.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.661 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 19.3 t -72.04 -33.33 67.91 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.049 0.452 . . . . 0.0 110.148 179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 11.0 tpt180 -78.97 -30.65 44.6 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.02 -178.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.813 HD13 HD22 ' A' 3575 ' ' LEU . 22.4 mt -93.49 -38.84 11.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.893 -177.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.461 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -144.64 74.93 14.94 Favored Pre-proline 0 C--N 1.326 -0.433 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 -176.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . 0.44 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 36.5 Cg_endo -66.58 -17.8 53.38 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 122.485 2.123 . . . . 0.0 112.324 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . 0.598 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.3 m-20 -72.66 -50.01 27.89 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-N 116.306 -0.407 . . . . 0.0 110.338 -177.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.652 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -82.56 -27.04 31.85 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.276 -0.639 . . . . 0.0 109.276 178.38 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.661 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -53.49 -42.99 67.85 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.156 177.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -65.18 -17.97 64.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.868 -0.606 . . . . 0.0 111.635 -178.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.688 ' HB3' HG13 ' A' 3496 ' ' VAL . 15.0 m -89.75 -34.19 16.29 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.923 0.392 . . . . 0.0 110.72 177.267 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.717 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.4 pt -85.52 -13.37 11.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 -174.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 12.0 p -56.72 -31.31 64.4 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.192 0.52 . . . . 0.0 110.464 175.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 9.4 t30 -83.31 -36.74 24.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.673 174.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.717 HG22 ' HA ' ' A' 3650 ' ' ILE . 20.8 tt -104.59 45.17 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 122.741 1.258 . . . . 0.0 110.103 -177.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.471 ' N ' ' HD2' ' A' 3655 ' ' PRO . 19.9 m -33.7 -42.0 0.36 Allowed Pre-proline 0 CA--C 1.541 0.624 0 CA-C-N 113.403 -1.726 . . . . 0.0 113.845 166.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.517 ' HD2' ' C ' ' A' 3653 ' ' ILE . 23.6 Cg_endo -65.02 84.16 0.18 Allowed 'Trans proline' 0 C--N 1.359 1.123 0 CA-C-N 120.532 1.226 . . . . 0.0 111.715 173.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 28.6 p80 -152.15 173.35 15.06 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.137 -178.218 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.423 HD22 HG22 ' A' 3628 ' ' ILE . 35.4 mt -121.98 142.27 50.49 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.165 178.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 58.6 ttp -105.16 111.23 23.9 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 176.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.843 HD12 HD21 ' A' 3524 ' ' LEU . 85.5 mt -103.61 119.59 52.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.264 0.554 . . . . 0.0 111.381 -172.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.691 HG13 ' HD2' ' A' 3573 ' ' TYR . 87.1 t -106.35 113.31 42.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.859 -177.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.654 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 46.8 mt -91.02 113.7 27.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.082 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.58 129.22 56.14 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 120.71 0.291 . . . . 0.0 111.503 -178.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 4.7 m -71.65 116.54 12.14 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 172.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 45.7 t . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.527 -0.749 . . . . 0.0 110.567 -177.578 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.525 ' CD1' ' HB2' ' A' 3553 ' ' MET . 22.9 m-85 . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 120.48 0.181 . . . . 0.0 111.352 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.912 ' HG3' ' H ' ' B' 2520 ' ' THR . 2.4 tp10 57.69 -159.19 0.26 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.884 0.373 . . . . 0.0 110.281 175.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.912 ' H ' ' HG3' ' B' 2519 ' ' GLU . 89.5 m -150.75 133.7 15.95 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 171.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.617 ' H ' ' C ' ' A' 3550 ' ' ALA . 35.7 tp -89.52 -121.05 0.06 Allowed 'General case' 0 CA--C 1.516 -0.354 0 C-N-CA 120.454 -0.499 . . . . 0.0 110.301 178.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.812 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . 0.557 ' HB2' ' H ' ' A' 3516 ' ' LYS . 43.5 t0 -163.13 96.32 0.88 Allowed 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 173.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 31.5 tt0 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.546 -177.781 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . . . . . . . . . 34.7 m . . . . . 0 N--CA 1.479 1.006 0 CA-C-O 120.981 0.42 . . . . 0.0 111.172 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 22.2 t70 -107.04 152.53 23.89 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.483 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 2.8 tpp -63.38 -28.9 70.31 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -175.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 77.4 t -58.54 -24.53 25.62 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 CA-C-O 120.949 0.404 . . . . 0.0 111.925 -175.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 2.9 mp0 -83.09 -57.57 3.22 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 120.408 -0.517 . . . . 0.0 110.399 177.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.576 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp -63.5 -35.69 81.29 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -173.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.633 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -68.12 -16.38 63.98 Favored 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.417 -172.307 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.633 ' N ' HD13 ' A' 3502 ' ' LEU . 0.7 OUTLIER -78.2 -21.03 50.67 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.18 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 42.5 mmtm -98.7 -43.0 6.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.356 0.598 . . . . 0.0 109.74 175.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.709 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -147.51 100.15 3.81 Favored Pre-proline 0 N--CA 1.444 -0.739 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.773 179.934 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 80.4 Cg_endo -82.71 173.89 10.03 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 123.985 3.123 . . . . 0.0 113.693 -179.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.575 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 90.3 mt -71.23 133.73 31.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.047 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.463 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.0 m -101.95 -30.0 3.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.481 -178.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.778 ' HE3' HD12 ' A' 3524 ' ' LEU . 26.1 t90 -147.04 154.64 41.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.652 0.263 . . . . 0.0 110.373 -174.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 36.3 tt0 -150.59 121.55 7.66 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 109.519 -0.549 . . . . 0.0 109.519 177.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -175.78 -129.33 1.2 Allowed Glycine 0 N--CA 1.441 -0.976 0 N-CA-C 111.335 -0.706 . . . . 0.0 111.335 -178.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.644 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -140.13 152.18 45.9 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.076 0.465 . . . . 0.0 111.07 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.473 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.0 mt -105.69 149.72 26.12 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 168.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.55 125.97 14.02 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -177.192 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.644 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.86 144.89 41.63 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 172.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.644 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.3 OUTLIER 62.63 -90.75 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.051 0.54 . . . . 0.0 110.337 -169.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -148.65 12.97 0.91 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.055 -0.975 . . . . 0.0 109.45 178.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.41 ' O ' ' HA ' ' A' 3514 ' ' ALA . 20.8 m-20 -106.01 144.06 33.26 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.76 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.514 HG22 ' HB2' ' A' 3514 ' ' ALA . 20.0 p -125.94 143.6 51.02 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.473 -177.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.67 115.06 13.36 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.256 174.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.644 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.44 116.34 12.77 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.956 0.407 . . . . 0.0 109.913 179.007 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.422 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -128.57 148.0 33.03 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 CA-C-O 121.607 0.718 . . . . 0.0 111.75 -175.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -109.26 125.36 52.19 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 108.854 173.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.842 HD21 HD12 ' A' 3659 ' ' ILE . 1.0 OUTLIER -94.51 112.42 24.19 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.39 0.614 . . . . 0.0 111.86 -174.784 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.575 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 62.9 m-70 -88.15 138.53 31.36 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.057 -0.974 . . . . 0.0 108.799 176.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.709 ' O ' ' HB2' ' A' 3505 ' ' TYR . 66.2 t80 -67.28 138.18 56.66 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 174.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.559 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.3 t -114.99 -58.38 3.52 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 CA-C-O 121.177 0.513 . . . . 0.0 110.971 177.484 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.508 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 58.3 m -160.2 171.4 19.28 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.537 -171.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.61 -148.96 20.26 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.125 178.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.552 ' HB2' ' HA ' ' A' 3571 ' ' THR . 44.0 t-20 -108.23 118.53 37.0 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.945 0.402 . . . . 0.0 110.117 179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.8 p30 -63.34 -28.21 69.85 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.907 -174.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 57.5 t -60.88 -33.47 55.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.752 0.311 . . . . 0.0 110.722 -177.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.536 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 19.7 mt -57.65 -42.68 83.97 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.076 177.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.401 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -68.38 -38.44 81.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.881 0.372 . . . . 0.0 110.907 -178.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 29.8 t60 -66.17 -36.48 83.22 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.708 -0.397 . . . . 0.0 110.612 -179.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -89.73 -6.29 56.19 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . . . . . . . . . 20.5 p -104.04 -43.34 5.3 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 122.005 -0.434 . . . . 0.0 111.271 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.662 HD13 ' HB2' ' A' 3509 ' ' TRP . 22.4 mt -79.36 110.81 16.5 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-O 120.982 0.42 . . . . 0.0 110.196 -173.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . 0.508 ' HD3' HG21 ' A' 3614 ' ' VAL . 36.6 Cg_endo -70.31 150.8 65.41 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.965 2.443 . . . . 0.0 112.87 -174.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 1.4 pp -167.46 155.27 9.03 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.386 177.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 19.6 m -155.86 -45.11 0.08 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.319 175.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.81 -23.67 12.31 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.957 -1.019 . . . . 0.0 110.346 176.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 176.71 -42.06 0.1 Allowed Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 114.803 -1.09 . . . . 0.0 111.402 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 151.03 116.68 0.75 Allowed Glycine 0 N--CA 1.448 -0.52 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.459 -179.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.49 ' HD2' ' O ' ' A' 3539 ' ' PRO . 74.4 Cg_endo -79.03 153.79 25.29 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 123.045 2.497 . . . . 0.0 112.108 177.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.622 ' HA ' ' O ' ' A' 3512 ' ' LEU . 29.0 Cg_endo -62.65 120.02 7.36 Favored 'Trans proline' 0 C--O 1.236 0.403 0 C-N-CA 122.675 2.25 . . . . 0.0 113.211 -177.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.733 ' HB3' HD13 ' A' 3612 ' ' ILE . 39.1 mt -69.27 118.64 12.42 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.834 174.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -99.22 139.23 35.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.841 0.353 . . . . 0.0 111.643 -174.342 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.407 ' CG2' HD13 ' B' 2521 ' ' LEU . 25.9 mt -95.6 107.83 20.16 Favored 'Isoleucine or valine' 0 C--O 1.241 0.634 0 CA-C-O 121.603 0.716 . . . . 0.0 111.609 -175.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.607 ' HB1' ' HB2' ' B' 2525 ' ' GLU . . . -118.08 1.98 12.02 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.002 -175.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.667 ' HA ' ' HA ' ' B' 2520 ' ' THR . 62.4 mt-30 -145.64 171.43 14.73 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.527 -0.175 . . . . 0.0 110.527 176.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.792 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.2 138.89 11.66 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 120.73 0.3 . . . . 0.0 111.172 -179.691 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.572 ' HG3' ' CE1' ' B' 2518 ' ' TYR . 10.8 tmm? -109.67 132.27 54.3 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 121.116 -0.233 . . . . 0.0 110.885 -178.11 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . 0.439 HH11 ' HD3' ' A' 3554 ' ' ARG . 0.1 OUTLIER -63.71 109.03 1.57 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.181 -179.426 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.554 ' HB2' HD21 ' A' 3560 ' ' LEU . 3.5 pp -81.95 97.27 8.0 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 122.754 1.264 . . . . 0.0 109.411 178.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.56 ' H ' ' HB2' ' A' 3559 ' ' GLN . 13.9 mm-40 -111.4 166.49 11.08 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 113.741 -1.572 . . . . 0.0 108.855 177.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.503 ' O ' ' HG3' ' A' 3561 ' ' GLU . . . -54.02 -52.39 60.97 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.973 0.416 . . . . 0.0 111.038 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 25.5 p -65.6 -40.1 92.31 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.138 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.56 ' HB2' ' H ' ' A' 3556 ' ' GLU . 15.9 mm100 -65.03 -40.45 94.85 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.276 -179.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.554 HD21 ' HB2' ' A' 3555 ' ' LEU . 98.5 mt -62.85 -37.94 88.85 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.772 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.503 ' HG3' ' O ' ' A' 3557 ' ' ALA . 12.8 mt-10 -68.65 -33.22 73.63 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 175.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . 0.481 ' O ' ' HB3' ' A' 3565 ' ' ARG . . . -64.75 -33.52 87.44 Favored Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.647 173.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.564 ' O ' ' HG2' ' A' 3566 ' ' ARG . 56.4 t -70.69 -45.75 72.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 174.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . 0.549 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.54 -27.03 64.16 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.122 178.736 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.481 ' HB3' ' O ' ' A' 3562 ' ' GLY . 75.5 ttt180 -55.3 -45.02 76.25 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.178 177.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . 0.564 ' HG2' ' O ' ' A' 3563 ' ' VAL . 9.2 ptp180 -87.2 -14.7 40.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.961 0.41 . . . . 0.0 110.844 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.549 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 78.0 mtp -83.3 -20.1 35.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.537 -176.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 11.2 t -88.1 4.04 46.83 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.959 0.409 . . . . 0.0 110.842 -178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 46.4 t -127.39 102.65 9.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-O 121.05 0.452 . . . . 0.0 110.748 178.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . 0.571 ' O ' ' HB ' ' A' 3571 ' ' THR . 1.7 mp0 -62.01 139.8 58.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.074 177.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.571 ' HB ' ' O ' ' A' 3570 ' ' GLU . 73.4 m 95.1 -27.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 O-C-N 124.199 0.937 . . . . 0.0 110.069 179.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -78.01 -31.57 50.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.72 171.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.731 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -138.28 167.17 22.42 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.048 177.708 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.643 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 29.4 t -129.11 135.99 49.62 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 171.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.759 HD22 HD13 ' A' 3642 ' ' LEU . 13.9 tp -106.58 126.31 52.11 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.614 HD11 HD11 ' A' 3661 ' ' ILE . 82.4 mt -128.17 151.79 48.82 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.596 -178.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.628 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -118.76 109.11 15.68 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.915 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.549 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.08 119.05 32.39 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.406 0.622 . . . . 0.0 110.469 -177.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.451 ' HG ' HD12 ' A' 3577 ' ' LEU . 82.9 mt -121.57 142.31 35.42 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 114.738 -1.119 . . . . 0.0 109.73 179.259 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -59.48 134.94 61.47 Favored 'Trans proline' 0 N--CA 1.462 -0.346 0 C-N-CA 122.234 1.956 . . . . 0.0 111.359 177.077 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 21.2 p -124.52 114.53 19.55 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.142 0.496 . . . . 0.0 110.461 179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . 0.404 ' HA2' ' OD2' ' A' 3587 ' ' ASP . . . -104.23 146.33 16.25 Favored Glycine 0 N--CA 1.443 -0.851 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.588 -178.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 13.1 mtm-85 -62.55 -48.87 77.6 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.757 0.789 . . . . 0.0 109.359 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.589 ' O ' HG23 ' A' 3588 ' ' VAL . 5.0 m-20 -125.87 174.95 8.01 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.177 -176.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -53.48 -48.4 68.95 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 123.347 0.404 . . . . 0.0 110.886 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -64.76 -38.96 92.76 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.58 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.446 ' HB3' ' H ' ' A' 3584 ' ' ASP . 27.8 t70 -65.15 -41.91 94.28 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.218 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' 3584 ' ' ASP . 79.2 t -57.25 -43.61 82.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.501 176.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 11.7 t -62.49 -50.91 77.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.481 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 6.0 m -55.83 -48.58 75.2 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.363 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 77.4 mm-40 -64.28 -41.71 96.76 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.577 0.227 . . . . 0.0 110.848 -178.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . 0.445 ' O ' ' HG3' ' A' 3596 ' ' LYS . 28.8 m -62.06 -43.84 97.96 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.033 0.444 . . . . 0.0 109.876 176.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -59.67 -51.08 71.32 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.98 178.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 32.4 m -59.37 -44.97 92.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.686 179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.5 HD12 ' HB2' ' A' 3599 ' ' PHE . 48.0 tp -62.38 -43.34 99.05 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.917 -178.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.516 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 55.4 mtmt -59.68 -51.73 68.55 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.624 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -69.77 -33.63 72.67 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.117 -0.492 . . . . 0.0 112.291 -175.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -95.45 -46.78 6.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.647 0.61 . . . . 0.0 112.647 -171.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.5 ' HB2' HD12 ' A' 3595 ' ' LEU . 27.3 m-85 -100.3 -51.03 3.75 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 -174.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.516 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.9 mm -62.38 -60.54 2.57 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.359 -173.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 88.0 m -58.0 -39.71 78.95 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.394 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.438 ' HE1' HD11 ' B' 2521 ' ' LEU . 45.6 t80 -71.74 -56.15 6.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.529 -176.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.553 HD12 ' O ' ' A' 3608 ' ' ALA . 0.3 OUTLIER -56.24 -39.81 73.14 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.726 -0.216 . . . . 0.0 111.329 -178.416 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 14.8 pt20 -75.88 -30.52 58.88 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.766 0.317 . . . . 0.0 110.297 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -65.79 -38.69 89.7 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.408 0.623 . . . . 0.0 110.248 176.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -79.5 -18.9 50.97 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.953 178.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . 0.443 ' O ' ' HG ' ' A' 3555 ' ' LEU . 52.5 mt-30 51.26 51.11 17.6 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -170.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.553 ' O ' HD12 ' A' 3603 ' ' LEU . . . -133.23 -177.68 4.63 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.739 -174.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.792 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -117.7 118.33 31.8 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.131 176.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . 0.511 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.2 104.18 0.85 Allowed Glycine 0 C--O 1.223 -0.548 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.492 178.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.666 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 37.3 mm -90.0 123.36 42.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.845 0 CA-C-O 121.188 0.518 . . . . 0.0 110.95 -175.714 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.733 HD13 ' HB3' ' A' 3547 ' ' LEU . 40.6 mt -118.52 105.96 18.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.83 175.318 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.465 ' HA ' ' O ' ' A' 3624 ' ' TYR . 11.7 m120 -84.74 109.33 17.97 Favored 'General case' 0 CA--C 1.513 -0.477 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.233 178.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.508 HG21 ' HD3' ' A' 3539 ' ' PRO . 10.7 p -116.2 136.8 23.09 Favored Pre-proline 0 C--N 1.314 -0.975 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.982 -172.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.523 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 60.6 Cg_endo -75.94 141.18 23.75 Favored 'Trans proline' 0 N--CA 1.457 -0.621 0 C-N-CA 122.374 2.05 . . . . 0.0 113.012 176.325 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.524 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 6.9 t30 -73.14 121.87 86.2 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.055 176.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 88.2 Cg_exo -47.45 128.5 15.08 Favored 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 123.653 2.902 . . . . 0.0 113.085 -177.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 96.2 -36.55 3.8 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.876 -0.678 . . . . 0.0 112.1 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 33.2 t -98.95 -28.52 13.39 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 120.614 0.245 . . . . 0.0 110.662 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . 0.512 ' HA ' ' HB2' ' A' 3615 ' ' PRO . 35.5 m-20 62.6 21.32 12.6 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.099 -176.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.509 ' OE1' ' HD2' ' A' 3622 ' ' PRO . 6.5 tp-100 -85.85 108.32 16.32 Favored Pre-proline 0 C--N 1.327 -0.375 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.806 177.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.523 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 74.9 Cg_endo -76.64 24.58 0.46 Allowed 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 123.339 2.692 . . . . 0.0 113.479 -176.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -77.4 48.77 0.67 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-O 121.033 0.444 . . . . 0.0 111.564 -177.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.524 ' HE2' ' HB2' ' A' 3616 ' ' ASN . 70.7 m-85 -139.34 133.86 31.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.082 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.443 HG13 HD12 ' A' 3611 ' ' ILE . 4.1 t -117.14 115.64 49.49 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.166 178.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.635 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -99.31 112.96 25.02 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 170.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.429 ' O ' ' HA ' ' A' 3659 ' ' ILE . 13.5 mt-30 -94.16 111.06 22.76 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.664 -177.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.608 HG12 HG12 ' A' 3659 ' ' ILE . 47.3 mt -93.97 99.46 9.59 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.548 -179.473 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -91.17 138.49 25.79 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.451 178.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -70.34 168.32 22.65 Favored 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.786 2.324 . . . . 0.0 111.677 176.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -64.81 81.52 0.18 Allowed 'Trans proline' 0 C--N 1.349 0.559 0 C-N-CA 122.805 2.337 . . . . 0.0 112.243 177.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 7.9 p -111.84 162.08 15.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.017 -176.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . 0.503 ' CD ' ' H ' ' A' 3633 ' ' GLU . 1.7 mp0 -54.72 -37.84 66.35 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.151 -179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . 0.433 ' CE2' ' HB3' ' A' 3560 ' ' LEU . 31.9 t80 -65.87 -42.78 89.91 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.097 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 67.1 p -62.86 -54.08 44.27 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.968 -178.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . 0.431 ' HG3' ' O ' ' A' 3633 ' ' GLU . 0.6 OUTLIER -59.55 -38.14 80.29 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.643 0.258 . . . . 0.0 111.375 -179.364 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 48.1 t -56.71 -53.19 60.63 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.816 178.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -74.3 -30.57 62.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.949 -178.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . 0.472 ' HB3' HD23 ' A' 3647 ' ' LEU . 49.2 mt -62.53 -39.64 94.21 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.444 0.164 . . . . 0.0 110.891 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.537 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 24.3 m -63.97 -39.66 94.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.198 0.523 . . . . 0.0 110.54 177.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 17.3 mmm180 -72.07 -43.4 64.94 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.675 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.759 HD13 HD22 ' A' 3575 ' ' LEU . 20.0 mt -83.5 -42.03 17.33 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.442 -173.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.437 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -142.63 83.5 11.7 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-O 120.828 0.347 . . . . 0.0 111.438 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -69.73 -26.03 28.14 Favored 'Trans proline' 0 CA--C 1.53 0.311 0 C-N-CA 122.666 2.244 . . . . 0.0 113.307 -175.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 5.6 t0 -71.84 -47.83 50.38 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -173.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.628 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.03 -29.37 49.35 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.359 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.537 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.14 -51.58 63.81 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.892 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.03 -25.4 66.88 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 120.933 0.397 . . . . 0.0 111.136 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 17.6 m -79.36 -36.35 39.49 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.029 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.573 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.4 pt -81.42 -10.44 12.23 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.237 0 CA-C-O 120.755 0.312 . . . . 0.0 111.349 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 9.4 t -59.08 -26.53 64.72 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.142 0.496 . . . . 0.0 109.701 174.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 13.9 m120 -79.68 -41.21 27.34 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.326 0.584 . . . . 0.0 110.111 175.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.573 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.6 tp -105.29 40.32 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-O 122.22 1.01 . . . . 0.0 109.821 -177.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.5 ' N ' ' HD2' ' A' 3655 ' ' PRO . 50.8 m -40.43 -40.61 2.08 Favored Pre-proline 0 CA--C 1.539 0.524 0 CA-C-N 114.521 -1.218 . . . . 0.0 113.6 173.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.5 ' HD2' ' N ' ' A' 3654 ' ' SER . 14.9 Cg_endo -60.24 78.57 0.07 OUTLIER 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 121.568 1.512 . . . . 0.0 111.864 169.065 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . 0.43 ' CB ' HD23 ' A' 3579 ' ' LEU . 32.6 p80 -150.46 -178.64 6.65 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.511 -0.768 . . . . 0.0 109.636 -179.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.482 ' HB3' HG23 ' A' 3628 ' ' ILE . 24.0 mt -124.74 142.59 51.3 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.71 -178.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 61.2 ttp -102.69 110.99 23.1 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.842 HD12 HD21 ' A' 3524 ' ' LEU . 84.0 mt -103.88 121.29 55.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-O 121.306 0.574 . . . . 0.0 111.492 -173.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.731 HG13 ' HD2' ' A' 3573 ' ' TYR . 85.1 t -107.27 116.4 50.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.661 -179.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.643 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 64.3 mt -90.81 112.19 24.71 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 109.643 -0.502 . . . . 0.0 109.643 177.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -108.52 128.52 54.88 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 120.881 0.372 . . . . 0.0 111.322 -178.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 9.2 m -68.95 114.63 7.42 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.005 174.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 63.2 t . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.914 -0.565 . . . . 0.0 110.155 179.196 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.572 ' CE1' ' HG3' ' A' 3553 ' ' MET . 8.0 m-85 . . . . . 0 N--CA 1.48 1.069 0 N-CA-C 111.172 0.064 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.596 ' HG2' ' H ' ' B' 2520 ' ' THR . 15.7 tt0 57.01 -158.74 0.26 Allowed 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 177.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.667 ' HA ' ' HA ' ' A' 3551 ' ' GLN . 8.0 t -157.44 124.55 5.13 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 172.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.664 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.4 OUTLIER -82.02 -129.15 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.705 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.51 ' N ' HD23 ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 24.9 t70 -166.0 -70.12 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.683 178.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . 0.607 ' HB2' ' HB1' ' A' 3550 ' ' ALA . 38.8 mt-10 . . . . . 0 C--O 1.247 0.94 0 CA-C-O 118.447 -0.787 . . . . 0.0 110.363 177.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.593 ' HA ' ' HA ' ' A' 3649 ' ' SER . 8.8 p . . . . . 0 N--CA 1.483 1.185 0 CA-C-O 121.473 0.654 . . . . 0.0 110.494 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . 0.477 ' OD2' ' HG3' ' A' 3500 ' ' GLN . 29.0 t70 -79.57 121.13 24.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.245 -174.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . 0.511 ' HA ' ' CD2' ' A' 3501 ' ' LEU . 69.6 mtm -82.7 -13.1 56.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.858 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.401 ' HA ' HD12 ' A' 3502 ' ' LEU . 45.6 t -73.8 -23.88 19.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.311 0.577 . . . . 0.0 111.092 -176.474 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . 0.477 ' HG3' ' OD2' ' A' 3497 ' ' ASP . 54.0 mt-30 -80.17 -48.11 13.66 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 122.085 -0.385 . . . . 0.0 110.507 176.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.611 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.3 pp -66.05 -37.18 85.18 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -174.019 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.666 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -71.82 -13.65 61.75 Favored 'General case' 0 N--CA 1.461 0.119 0 C-N-CA 120.281 -0.568 . . . . 0.0 110.429 -173.301 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.543 ' N ' HD13 ' A' 3502 ' ' LEU . 51.4 tptt -67.64 -23.7 65.37 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 109.516 -0.55 . . . . 0.0 109.516 174.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 36.0 mmtm -103.27 -42.66 5.67 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.261 176.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.684 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -146.87 103.08 3.88 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-O 121.471 0.653 . . . . 0.0 110.796 179.252 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . 0.666 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 94.0 Cg_endo -82.11 174.39 10.1 Favored 'Trans proline' 0 N--CA 1.461 -0.424 0 C-N-CA 123.972 3.115 . . . . 0.0 113.556 -176.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.518 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 82.1 mt -71.22 133.12 32.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.536 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.475 HG13 ' HB2' ' A' 3526 ' ' PHE . 33.8 m -101.89 -24.55 4.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.364 -178.381 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.638 ' HB2' HD13 ' A' 3538 ' ' LEU . 50.4 t-105 -156.13 154.73 31.34 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.805 0.336 . . . . 0.0 110.786 -176.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -147.57 120.08 8.5 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -171.1 -132.92 1.54 Allowed Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.723 -177.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.574 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -139.83 149.0 42.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.182 0.515 . . . . 0.0 111.546 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.486 HD23 ' HB2' ' A' 3547 ' ' LEU . 93.8 mt -105.1 144.38 31.97 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 108.161 -1.052 . . . . 0.0 108.161 170.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.696 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -141.98 124.44 15.74 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.738 0.304 . . . . 0.0 111.61 -177.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.67 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.31 146.37 44.54 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.041 -0.726 . . . . 0.0 109.041 173.903 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.67 ' CD ' HD12 ' A' 3515 ' ' LEU . 1.2 mptm? 62.64 -93.69 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -167.066 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 22.4 m120 -147.26 11.95 1.04 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.343 175.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.451 ' O ' ' HA ' ' A' 3514 ' ' ALA . 3.9 t0 -100.09 138.72 36.78 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.129 -175.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.615 HG22 ' HB2' ' A' 3514 ' ' ALA . 28.0 p -123.58 127.69 48.66 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.087 0.47 . . . . 0.0 111.88 -175.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -120.71 115.64 23.72 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.864 -0.607 . . . . 0.0 109.395 175.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.574 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.75 120.78 18.85 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 178.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.429 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -130.38 147.93 33.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.538 0.685 . . . . 0.0 111.834 -175.255 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 25.5 pt20 -111.1 126.09 54.46 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 114.948 -1.024 . . . . 0.0 108.986 173.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.938 HD21 HD12 ' A' 3659 ' ' ILE . 0.8 OUTLIER -95.51 112.63 24.31 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-O 121.34 0.59 . . . . 0.0 111.986 -173.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.518 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 74.9 m-70 -85.53 140.28 30.78 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.757 174.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.684 ' O ' ' HB2' ' A' 3505 ' ' TYR . 58.9 t80 -70.17 136.64 50.28 Favored 'General case' 0 C--N 1.317 -0.823 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 175.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.598 ' CG1' HD23 ' A' 3575 ' ' LEU . 19.6 t -115.36 -51.96 4.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-O 121.081 0.467 . . . . 0.0 111.372 178.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 25.8 t -162.19 170.39 19.15 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.706 -0.679 . . . . 0.0 109.706 -170.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.25 -149.21 21.19 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.854 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.544 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.5 t-20 -104.7 117.02 33.05 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.773 0.32 . . . . 0.0 110.713 -178.375 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 12.2 p30 -61.15 -36.28 79.38 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . 0.446 HG12 ' HD2' ' A' 3536 ' ' ARG . 57.8 t -59.95 -33.41 52.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.559 0.218 . . . . 0.0 110.489 179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.54 HD23 ' HD3' ' A' 3536 ' ' ARG . 16.4 mt -56.7 -40.99 76.6 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.235 178.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.453 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.81 -47.26 72.63 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.885 0.374 . . . . 0.0 110.378 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -59.89 -35.59 75.17 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.946 -179.233 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.54 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.4 ptm180 -88.95 -11.09 45.37 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -177.02 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.523 ' O ' HG21 ' A' 3614 ' ' VAL . 57.5 p -103.05 -37.52 7.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.976 0.417 . . . . 0.0 111.227 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.638 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.3 mt -78.88 112.01 24.14 Favored Pre-proline 0 C--N 1.321 -0.637 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -174.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -66.45 139.84 55.48 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 123.255 2.636 . . . . 0.0 113.989 -166.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 2.3 pp -156.77 153.13 27.85 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.161 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 51.0 m -164.82 -46.61 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.44 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -116.15 -47.37 2.77 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.329 -0.851 . . . . 0.0 109.718 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . -147.75 -58.44 0.01 OUTLIER Glycine 0 C--N 1.311 -0.856 0 CA-C-N 114.479 -1.237 . . . . 0.0 111.617 178.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 161.02 99.18 0.14 Allowed Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.94 -0.648 . . . . 0.0 112.234 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -72.42 141.93 36.01 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.459 2.106 . . . . 0.0 111.2 176.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -67.41 143.2 62.61 Favored 'Trans proline' 0 N--CA 1.463 -0.278 0 C-N-CA 122.625 2.217 . . . . 0.0 112.614 -176.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.707 ' HB3' HD13 ' A' 3612 ' ' ILE . 57.0 mt -78.0 118.05 19.91 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.264 177.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.696 ' HA ' ' O ' ' A' 3514 ' ' ALA . 23.8 ptt180 -103.52 141.62 35.69 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.074 0.464 . . . . 0.0 111.401 -177.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.481 HD12 HD22 ' A' 3515 ' ' LEU . 19.5 mt -94.12 107.23 19.04 Favored 'Isoleucine or valine' 0 C--O 1.254 1.326 0 CA-C-O 122.705 1.24 . . . . 0.0 111.648 -172.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.468 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -108.94 -6.52 15.69 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.51 -1.223 . . . . 0.0 111.891 -173.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.686 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 52.6 mt-30 -148.29 176.95 9.83 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.363 0.125 . . . . 0.0 111.142 179.044 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.711 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -155.83 136.79 13.62 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 120.884 0.374 . . . . 0.0 111.585 -178.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.603 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 14.1 tmm? -110.39 121.67 45.85 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.398 177.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 33.5 mtm180 -71.78 110.64 6.45 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -177.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.549 ' HB2' HD21 ' A' 3560 ' ' LEU . 2.9 pp -71.98 98.65 2.09 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 122.278 1.037 . . . . 0.0 110.054 -176.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.612 ' O ' ' HG ' ' A' 3560 ' ' LEU . 43.4 mt-10 -113.09 166.42 11.45 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.309 176.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -53.24 -47.48 68.99 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.063 0.459 . . . . 0.0 111.11 179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 1.6 p -63.04 -38.39 91.02 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.507 178.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.891 HE21 ' HA ' ' A' 3559 ' ' GLN . 0.0 OUTLIER -74.27 -37.59 63.67 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.168 -177.521 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.612 ' HG ' ' O ' ' A' 3556 ' ' GLU . 86.0 mt -61.72 -35.32 77.72 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.729 0.3 . . . . 0.0 110.488 179.099 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -62.85 -46.17 89.16 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.961 173.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -62.32 -34.07 88.1 Favored Glycine 0 CA--C 1.519 0.323 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.499 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.565 ' O ' ' HG3' ' A' 3567 ' ' MET . 59.2 t -66.87 -49.5 73.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 174.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . 0.566 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.74 -27.54 68.02 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.063 178.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? -54.76 -47.34 74.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.533 177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.2 ptp85 -85.17 -14.41 47.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.078 179.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.566 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 87.6 mtp -83.08 -19.58 36.54 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.804 0.335 . . . . 0.0 111.153 -179.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . 0.43 HG23 ' O ' ' A' 3564 ' ' ALA . 37.0 p -80.36 -21.45 42.4 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.144 0.497 . . . . 0.0 110.549 177.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 23.3 t -106.19 78.65 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.572 177.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.66 108.21 1.99 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.051 -0.522 . . . . 0.0 109.665 177.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.544 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.7 m 155.96 -45.85 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 125.373 1.469 . . . . 0.0 107.732 -173.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -86.76 -14.86 41.11 Favored 'General case' 0 CA--C 1.517 -0.304 0 CA-C-N 115.146 -0.934 . . . . 0.0 111.295 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.656 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -134.81 162.88 31.12 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 120.391 -0.524 . . . . 0.0 109.758 175.475 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.622 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 34.2 t -128.23 133.94 48.92 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 173.312 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.783 HD22 HD13 ' A' 3642 ' ' LEU . 12.6 tp -105.61 125.41 50.96 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 178.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.588 HD11 HD11 ' A' 3661 ' ' ILE . 81.4 mt -125.78 154.52 42.43 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.85 -177.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.722 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.72 108.14 13.62 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.186 179.76 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.451 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.28 123.64 37.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.236 0.541 . . . . 0.0 110.591 -178.08 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.414 HD23 ' HB2' ' A' 3656 ' ' HIS . 73.7 mt -124.63 143.71 44.22 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.258 -179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -59.47 117.96 4.78 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.46 2.107 . . . . 0.0 112.21 178.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.7 p -110.08 119.62 39.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.127 0.489 . . . . 0.0 110.029 179.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -102.82 145.19 16.27 Favored Glycine 0 N--CA 1.443 -0.873 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.735 -177.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 44.3 mtm180 -70.52 -25.18 63.0 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.782 0.801 . . . . 0.0 109.87 177.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.576 ' O ' HG23 ' A' 3588 ' ' VAL . 23.9 t70 -147.9 169.95 18.72 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 114.354 -1.294 . . . . 0.0 108.257 -175.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -53.53 -49.59 67.3 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -60.93 -37.96 84.14 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.688 179.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.556 ' HB3' ' H ' ' A' 3584 ' ' ASP . 6.4 t70 -66.97 -40.83 87.53 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.548 -177.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.576 HG23 ' O ' ' A' 3584 ' ' ASP . 94.1 t -58.68 -39.49 76.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-O 121.178 0.514 . . . . 0.0 110.385 178.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 3.0 t -63.49 -48.27 87.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.457 177.547 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 71.9 m -58.72 -47.31 85.02 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 114.178 -1.374 . . . . 0.0 111.703 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' 3587 ' ' ASP . 71.6 mm-40 -63.87 -45.08 91.02 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.478 0.18 . . . . 0.0 110.758 -179.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 46.3 m -57.59 -47.4 82.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.16 178.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.42 ' HA ' ' HE3' ' A' 3596 ' ' LYS . 9.5 tp10 -60.91 -50.7 72.37 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.887 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 19.4 m -60.65 -45.25 94.82 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.187 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.529 HD12 ' HB2' ' A' 3599 ' ' PHE . 44.8 tp -64.08 -45.93 86.54 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.568 -175.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.785 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -71.29 -25.55 62.49 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.333 -0.547 . . . . 0.0 111.061 -176.164 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.55 -40.56 18.96 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.403 178.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.493 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -92.36 -45.97 7.92 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -171.105 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.529 ' HB2' HD12 ' A' 3595 ' ' LEU . 21.1 m-85 -98.47 -50.17 4.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.676 -0.238 . . . . 0.0 111.256 -174.438 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.785 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 21.8 mm -61.46 -58.09 9.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.738 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 98.0 m -55.57 -41.06 72.77 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 123.352 0.407 . . . . 0.0 111.456 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.749 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -68.48 -56.98 6.56 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.614 -0.267 . . . . 0.0 111.333 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.749 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.52 -43.55 79.89 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.526 0.203 . . . . 0.0 111.521 -177.182 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -68.07 -37.29 81.1 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.496 -177.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.25 -37.3 77.88 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.038 0.447 . . . . 0.0 110.822 -179.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -77.35 -18.6 57.25 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.824 179.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 50.03 53.03 13.54 Favored 'General case' 0 C--O 1.233 0.226 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -169.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.52 ' O ' HD12 ' A' 3603 ' ' LEU . . . -135.69 -176.02 4.15 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.883 -0.599 . . . . 0.0 112.312 -171.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.711 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.05 118.26 30.15 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.499 176.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . 0.424 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.93 103.78 0.84 Allowed Glycine 0 C--O 1.222 -0.605 0 C-N-CA 120.809 -0.71 . . . . 0.0 111.485 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.686 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 31.0 mm -88.99 120.37 37.57 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-O 121.175 0.512 . . . . 0.0 111.055 -174.102 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.707 HD13 ' HB3' ' A' 3547 ' ' LEU . 35.0 mt -119.24 117.83 55.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.879 176.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.542 ' HA ' ' O ' ' A' 3624 ' ' TYR . 15.9 m120 -96.73 126.04 41.62 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.348 -178.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.646 HG22 ' HB2' ' A' 3624 ' ' TYR . 3.4 m -119.56 158.61 48.78 Favored Pre-proline 0 C--N 1.32 -0.691 0 N-CA-C 109.565 -0.531 . . . . 0.0 109.565 176.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.642 ' HA ' ' O ' ' A' 3621 ' ' GLN . 20.5 Cg_endo -61.64 140.99 89.56 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.343 2.029 . . . . 0.0 113.914 -179.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.567 ' HB2' ' CD2' ' A' 3624 ' ' TYR . 40.9 t30 -138.82 92.59 11.14 Favored Pre-proline 0 C--O 1.238 0.478 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.797 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -63.58 107.14 0.68 Allowed 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 122.945 2.43 . . . . 0.0 112.11 -178.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 137.28 -27.39 2.88 Favored Glycine 0 N--CA 1.444 -0.813 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.863 178.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 52.8 m -102.37 -37.3 8.11 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.155 -0.618 . . . . 0.0 112.198 -176.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -177.12 -79.41 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 N-CA-C 109.711 -0.478 . . . . 0.0 109.711 177.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.686 ' HB2' ' HD3' ' A' 3622 ' ' PRO . 0.3 OUTLIER -154.21 -66.85 0.02 OUTLIER Pre-proline 0 C--O 1.218 -0.593 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.108 173.858 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.686 ' HD3' ' HB2' ' A' 3621 ' ' GLN . 85.7 Cg_endo -102.66 27.78 0.1 Allowed 'Trans proline' 0 C--N 1.353 0.81 0 C-N-CA 123.638 2.892 . . . . 0.0 112.942 -175.413 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . 0.594 ' HB1' ' HB ' ' A' 3664 ' ' VAL . . . -70.85 49.12 0.12 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -170.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.646 ' HB2' HG22 ' A' 3614 ' ' VAL . 19.5 m-85 -133.74 133.76 42.15 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 166.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 10.7 t -117.76 114.12 44.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.555 177.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.62 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -99.36 111.19 23.6 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 169.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.547 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 40.5 mt-30 -93.85 111.76 23.5 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.016 -0.538 . . . . 0.0 109.928 -178.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.596 HG12 HG12 ' A' 3659 ' ' ILE . 42.1 mt -89.14 98.05 7.64 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.166 178.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -87.48 141.94 32.69 Favored Pre-proline 0 C--N 1.32 -0.674 0 CA-C-N 115.949 -0.569 . . . . 0.0 109.86 177.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.514 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 53.4 Cg_endo -69.3 172.96 11.27 Favored 'Trans proline' 0 CA--C 1.53 0.31 0 C-N-CA 122.656 2.237 . . . . 0.0 111.513 176.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -71.88 40.36 0.42 Allowed 'Trans proline' 0 CA--C 1.532 0.376 0 C-N-CA 122.801 2.334 . . . . 0.0 112.571 176.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 22.6 p -72.05 161.63 30.62 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.852 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -51.2 -39.58 56.81 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.003 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 33.9 t80 -50.76 -53.88 28.03 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.04 175.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 5.6 m -62.72 -56.81 14.24 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.92 -177.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.45 -41.81 69.87 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.881 -175.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 21.3 m -67.46 -47.89 68.82 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.128 -176.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -64.24 -35.77 81.9 Favored 'General case' 0 CA--C 1.52 -0.201 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.271 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 85.7 mt -63.22 -34.16 77.06 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.962 176.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.677 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 37.7 m -67.02 -29.63 69.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.76 -179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.59 -56.45 3.6 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.166 176.309 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.783 HD13 HD22 ' A' 3575 ' ' LEU . 19.2 mt -66.04 -38.5 88.54 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.342 -171.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.432 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -144.81 74.57 14.74 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.834 -0.166 . . . . 0.0 111.385 -178.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -67.76 -19.21 47.5 Favored 'Trans proline' 0 N--CA 1.462 -0.357 0 C-N-CA 122.393 2.062 . . . . 0.0 111.74 -178.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . 0.567 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 1.5 m-20 -73.5 -51.58 16.6 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.004 -179.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.722 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -77.85 -30.09 50.82 Favored 'General case' 0 N--CA 1.438 -1.027 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 -179.58 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.677 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -53.82 -47.34 70.97 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.33 177.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.55 -28.95 68.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.058 0.456 . . . . 0.0 111.148 -179.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.593 ' HA ' ' HA ' ' A' 3496 ' ' VAL . 20.1 m -81.44 -33.34 32.16 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.041 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.622 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.8 pt -83.95 -10.44 11.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.86 -0.336 . . . . 0.0 111.235 -178.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 38.4 m -55.36 -33.61 63.56 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.361 176.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -84.0 -33.01 24.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.647 179.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.622 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.5 tp -105.43 38.31 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-O 122.41 1.1 . . . . 0.0 109.335 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.488 ' N ' ' HD2' ' A' 3655 ' ' PRO . 22.9 t -39.27 -40.84 1.39 Allowed Pre-proline 0 CA--C 1.543 0.692 0 CA-C-N 113.996 -1.456 . . . . 0.0 113.606 173.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.488 ' HD2' ' N ' ' A' 3654 ' ' SER . 17.6 Cg_endo -60.21 80.79 0.07 OUTLIER 'Trans proline' 0 C--N 1.36 1.14 0 C-N-CA 121.647 1.565 . . . . 0.0 111.597 168.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . 0.414 ' HB2' HD23 ' A' 3579 ' ' LEU . 21.7 p80 -146.72 177.14 9.32 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.687 -177.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.462 HD22 HG22 ' A' 3628 ' ' ILE . 39.1 mt -122.41 146.93 46.9 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.278 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 61.6 ttp -109.05 107.28 17.55 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 174.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.938 HD12 HD21 ' A' 3524 ' ' LEU . 81.2 mt -99.05 116.35 41.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.295 0.569 . . . . 0.0 111.218 -172.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.656 HG13 ' HD2' ' A' 3573 ' ' TYR . 94.0 t -103.07 113.91 41.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.993 -177.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.622 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 62.7 mt -90.56 122.15 41.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.154 179.487 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -116.89 127.94 54.76 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.354 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 5.2 p -93.13 131.98 37.68 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.097 0.475 . . . . 0.0 110.868 178.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . 0.594 ' HB ' ' HB1' ' A' 3623 ' ' ALA . 30.6 t . . . . . 0 C--O 1.244 0.812 0 CA-C-O 118.785 -0.626 . . . . 0.0 110.021 179.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.603 ' CD1' ' HB2' ' A' 3553 ' ' MET . 24.5 m-85 . . . . . 0 N--CA 1.48 1.059 0 N-CA-C 111.223 0.083 . . . . 0.0 111.223 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.502 ' CB ' ' HG2' ' A' 3552 ' ' ARG . 0.4 OUTLIER 54.96 -162.04 0.15 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.613 0.721 . . . . 0.0 111.704 177.589 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.498 ' HA ' ' HG2' ' A' 3551 ' ' GLN . 18.7 m -147.3 123.53 10.88 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 107.145 -1.428 . . . . 0.0 107.145 168.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.611 ' HG ' ' N ' ' B' 2522 ' ' SEP . 34.9 tp -81.39 -120.98 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.517 0 C-N-CA 119.54 -0.864 . . . . 0.0 109.956 179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.653 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . 0.498 ' OD1' ' HD2' ' A' 3548 ' ' ARG . 14.7 t70 -158.07 -58.38 0.08 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.236 -1.347 . . . . 0.0 108.713 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 . . . . . 0 C--O 1.249 1.056 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.471 -177.964 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.445 HG21 ' HA ' ' A' 3649 ' ' SER . 14.3 m . . . . . 0 N--CA 1.479 1.01 0 CA-C-O 121.258 0.551 . . . . 0.0 110.786 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -106.3 144.93 32.29 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.929 -179.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . 0.634 ' HA ' ' CD2' ' A' 3501 ' ' LEU . 27.0 ptm -74.39 -19.09 60.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.195 0.521 . . . . 0.0 109.605 174.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.41 ' HA ' HD12 ' A' 3502 ' ' LEU . 47.6 t -60.32 -24.26 30.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.155 -0.93 . . . . 0.0 110.581 175.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -78.45 -59.14 2.9 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.273 175.035 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.634 ' CD2' ' HA ' ' A' 3498 ' ' MET . 2.9 pp -63.77 -35.74 81.6 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.455 -0.793 . . . . 0.0 113.007 -173.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.614 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.46 -15.73 62.85 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 120.167 -0.613 . . . . 0.0 110.683 -172.071 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.614 ' N ' HD13 ' A' 3502 ' ' LEU . 18.6 tptm -74.58 -16.3 60.81 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 177.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 44.3 mmtm -105.23 -43.11 5.09 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.818 173.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.729 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.68 102.48 3.45 Favored Pre-proline 0 N--CA 1.447 -0.614 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.24 -178.759 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -85.97 174.25 6.5 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 124.347 3.365 . . . . 0.0 113.602 -178.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.56 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 97.6 mt -71.98 137.18 24.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.938 -179.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 29.6 m -104.24 -24.75 3.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.654 -178.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.634 ' CB ' HD13 ' A' 3538 ' ' LEU . 39.2 t90 -158.22 152.6 24.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.667 -0.242 . . . . 0.0 110.38 -176.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . 0.445 ' HG3' ' HB3' ' A' 3523 ' ' GLN . 26.2 tt0 -148.2 119.94 8.08 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.886 -0.413 . . . . 0.0 109.886 178.126 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . 0.431 ' HA3' ' HA3' ' A' 3544 ' ' GLY . . . -166.54 -128.72 1.0 Allowed Glycine 0 N--CA 1.442 -0.948 0 N-CA-C 110.974 -0.851 . . . . 0.0 110.974 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.7 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.0 mp -139.18 156.63 46.97 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.161 0.505 . . . . 0.0 111.101 178.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.491 HD23 ' HB2' ' A' 3547 ' ' LEU . 72.7 mt -109.48 151.67 26.41 Favored 'General case' 0 C--N 1.317 -0.842 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 169.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.781 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.76 124.04 13.0 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.698 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.702 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.08 142.9 38.14 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 171.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.702 ' HD3' HD12 ' A' 3515 ' ' LEU . 2.0 mptp? 63.79 -95.01 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -169.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . 0.412 HD22 ' HA ' ' A' 3517 ' ' ASN . 7.0 m120 -143.38 9.65 1.64 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.007 -0.997 . . . . 0.0 108.73 175.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.466 ' O ' ' HA ' ' A' 3514 ' ' ALA . 13.4 m-20 -94.89 128.75 41.89 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.164 -175.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.482 HG22 ' HB2' ' A' 3514 ' ' ALA . 29.0 p -118.45 134.48 55.03 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.059 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -129.04 116.37 19.2 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 176.103 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.619 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.48 119.59 14.88 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 120.933 0.397 . . . . 0.0 109.955 178.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' 3579 ' ' LEU . 28.0 m -128.08 147.55 32.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.664 0.745 . . . . 0.0 111.867 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . 0.445 ' HB3' ' HG3' ' A' 3510 ' ' GLN . 4.4 pt20 -112.29 125.17 53.88 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.599 -1.182 . . . . 0.0 108.58 173.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.827 HD21 HD12 ' A' 3659 ' ' ILE . 0.7 OUTLIER -96.89 112.34 24.14 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.278 0.561 . . . . 0.0 111.851 -174.773 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.56 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 73.5 m-70 -82.98 138.69 33.68 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.113 -0.948 . . . . 0.0 108.646 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.729 ' O ' ' HB2' ' A' 3505 ' ' TYR . 68.5 t80 -66.41 136.34 55.61 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 173.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.566 ' CG1' HD23 ' A' 3575 ' ' LEU . 18.9 t -115.2 -54.56 4.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 CA-C-O 121.247 0.546 . . . . 0.0 110.931 177.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.411 ' OG ' HD22 ' A' 3642 ' ' LEU . 28.7 t -159.1 170.42 22.05 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.124 -169.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.11 -147.11 20.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.909 -0.662 . . . . 0.0 113.23 174.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.527 ' HB2' ' HA ' ' A' 3571 ' ' THR . 41.9 t30 -107.6 108.97 20.48 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 110.261 -0.274 . . . . 0.0 110.261 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -63.17 -26.66 68.91 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.526 -0.307 . . . . 0.0 111.706 -175.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 47.4 t -59.27 -32.31 48.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.636 178.788 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.518 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 25.2 mt -57.8 -44.6 86.44 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.009 177.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -65.0 -42.19 94.69 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-O 120.765 0.317 . . . . 0.0 110.642 -178.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -58.34 -41.57 84.92 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.695 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.575 ' O ' ' HD2' ' A' 3617 ' ' PRO . 27.5 ptt180 -89.98 -4.95 57.17 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . . . . . . . . . 13.3 p -104.43 -40.68 5.98 Favored 'General case' 0 C--N 1.327 -0.373 0 O-C-N 121.891 -0.506 . . . . 0.0 111.514 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.634 HD13 ' CB ' ' A' 3509 ' ' TRP . 22.9 mt -80.32 115.68 56.46 Favored Pre-proline 0 C--N 1.32 -0.694 0 CA-C-O 121.208 0.528 . . . . 0.0 110.874 -172.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . 0.44 ' HD3' HG21 ' A' 3614 ' ' VAL . 58.6 Cg_endo -78.26 150.96 26.13 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 123.03 2.487 . . . . 0.0 112.979 -176.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.493 ' HA ' ' CD ' ' A' 3545 ' ' PRO . 2.5 pp -151.69 170.54 19.48 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.95 177.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 21.5 p 175.14 -60.22 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.153 -176.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -96.94 -13.93 22.07 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.89 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 154.94 -61.45 0.37 Allowed Glycine 0 C--N 1.311 -0.85 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.536 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . 0.431 ' HA3' ' HA3' ' A' 3511 ' ' GLY . . . -164.84 88.48 0.1 Allowed Glycine 0 N--CA 1.442 -0.906 0 N-CA-C 111.68 -0.568 . . . . 0.0 111.68 174.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.493 ' CD ' ' HA ' ' A' 3540 ' ' LEU . 31.8 Cg_exo -56.99 142.36 93.9 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.573 2.182 . . . . 0.0 111.328 178.138 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.7 ' HA ' ' O ' ' A' 3512 ' ' LEU . 56.4 Cg_endo -71.53 118.14 5.5 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 122.284 1.989 . . . . 0.0 112.76 -172.118 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.693 ' HB3' HD13 ' A' 3612 ' ' ILE . 37.1 mt -68.3 109.69 3.73 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.218 174.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.781 ' HA ' ' O ' ' A' 3514 ' ' ALA . 14.9 ptt180 -96.1 139.73 31.84 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.358 0.599 . . . . 0.0 111.48 -173.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.47 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.8 mt -93.82 107.81 19.75 Favored 'Isoleucine or valine' 0 C--O 1.245 0.848 0 CA-C-O 122.037 0.922 . . . . 0.0 111.603 -172.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.523 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -116.85 5.37 13.0 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.363 -175.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.709 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 42.3 mt-30 -149.4 165.82 30.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.391 179.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.691 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -155.09 138.31 15.69 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.923 0.392 . . . . 0.0 110.923 -179.783 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.555 ' HG3' ' CE2' ' B' 2518 ' ' TYR . 13.7 tmm? -111.25 121.54 45.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.5 177.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 9.8 mmt180 -63.01 109.88 1.62 Allowed 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 109.959 -0.385 . . . . 0.0 109.959 179.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.631 ' O ' HD12 ' A' 3555 ' ' LEU . 3.4 pp -70.06 99.16 1.41 Allowed 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 122.5 1.143 . . . . 0.0 109.703 -177.203 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' 3560 ' ' LEU . 8.4 mm-40 -104.91 152.39 22.71 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.291 178.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.576 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -53.25 -48.23 68.4 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 175.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 22.2 m -58.08 -43.84 87.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.386 -0.825 . . . . 0.0 111.597 176.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.551 ' O ' HG23 ' A' 3563 ' ' VAL . 12.1 mm100 -66.06 -45.7 80.42 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.999 -179.35 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' 3556 ' ' GLU . 94.0 mt -62.88 -36.38 83.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.447 -179.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' 3557 ' ' ALA . 8.7 mm-40 -56.19 -51.19 68.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.39 172.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -60.9 -41.73 99.4 Favored Glycine 0 CA--C 1.521 0.431 0 CA-C-N 115.348 -0.842 . . . . 0.0 112.548 178.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.551 HG23 ' O ' ' A' 3559 ' ' GLN . 63.1 t -62.6 -48.88 86.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.882 0.372 . . . . 0.0 110.456 177.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -59.78 -30.92 69.21 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.71 -177.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.516 ' O ' ' HB ' ' A' 3568 ' ' THR . 34.5 ttm180 -60.53 -40.65 92.26 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.741 0.305 . . . . 0.0 111.192 179.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 31.0 ptt180 -86.6 -10.01 54.84 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.591 -0.444 . . . . 0.0 110.335 178.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.479 ' HG3' ' O ' ' A' 3563 ' ' VAL . 83.1 mtp -83.25 -20.51 34.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.961 0.886 . . . . 0.0 108.969 171.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . 0.516 ' HB ' ' O ' ' A' 3565 ' ' ARG . 23.2 m -75.5 -15.54 60.39 Favored 'General case' 0 N--CA 1.433 -1.282 0 CA-C-N 114.174 -1.376 . . . . 0.0 110.26 177.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 47.7 t -116.45 90.09 1.47 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.987 177.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -70.39 108.26 4.17 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.583 -0.525 . . . . 0.0 109.583 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.527 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 153.26 -45.48 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 O-C-N 125.057 1.473 . . . . 0.0 107.98 -174.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -76.08 -30.71 58.42 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.602 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.768 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -126.76 165.79 18.62 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.392 179.269 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.629 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 51.2 t -127.42 134.53 49.88 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 171.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.835 HD22 HD13 ' A' 3642 ' ' LEU . 15.2 tp -105.56 126.91 52.68 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.635 HD11 HD11 ' A' 3661 ' ' ILE . 76.9 mt -125.9 154.51 42.65 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.149 0.5 . . . . 0.0 110.934 -177.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.729 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -121.55 108.33 13.48 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.472 -0.786 . . . . 0.0 109.074 179.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.526 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 123.33 37.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.365 0.602 . . . . 0.0 110.748 -177.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.419 HD23 ' HB2' ' A' 3656 ' ' HIS . 85.5 mt -123.35 143.59 41.64 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 114.729 -1.123 . . . . 0.0 109.943 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . 0.411 ' HA ' ' O ' ' A' 3521 ' ' ALA . 21.5 Cg_endo -61.8 110.99 1.07 Allowed 'Trans proline' 0 C--O 1.235 0.368 0 C-N-CA 122.341 2.028 . . . . 0.0 112.038 178.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.4 p -95.97 114.33 26.03 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.337 0.589 . . . . 0.0 110.532 -178.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.93 145.9 16.22 Favored Glycine 0 N--CA 1.442 -0.96 0 C-N-CA 120.659 -0.781 . . . . 0.0 112.542 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' 3583 ' ' ARG . 34.1 ttp180 -60.19 -47.69 84.88 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 123.728 0.811 . . . . 0.0 110.73 175.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.56 ' O ' HG23 ' A' 3588 ' ' VAL . 2.2 p30 -134.92 179.78 6.1 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.3 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -54.98 -46.65 75.12 Favored 'General case' 0 C--N 1.328 -0.34 0 O-C-N 123.246 0.341 . . . . 0.0 111.57 -175.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -67.31 -40.82 86.05 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 -179.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.44 ' HB3' ' H ' ' A' 3584 ' ' ASP . 19.5 t70 -60.61 -42.53 97.02 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.289 179.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' 3584 ' ' ASP . 81.1 t -57.46 -49.26 80.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.368 176.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . 0.438 ' O ' ' HG2' ' A' 3593 ' ' GLU . 93.7 t -59.66 -49.37 83.99 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.369 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 29.7 t -59.43 -43.2 93.12 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.24 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -68.9 -36.09 77.62 Favored 'General case' 0 C--N 1.325 -0.488 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.841 178.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 88.5 m -63.01 -54.29 40.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.857 0.36 . . . . 0.0 110.78 178.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.9 pt-20 -62.88 -34.68 77.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.32 -178.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 50.6 m -70.22 -42.09 72.74 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.647 0.261 . . . . 0.0 110.721 178.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.594 HD12 ' HB2' ' A' 3599 ' ' PHE . 58.8 tp -63.15 -45.48 91.67 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.999 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.821 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 21.2 ptmt -67.51 -29.82 69.33 Favored 'General case' 0 C--N 1.331 -0.215 0 C-N-CA 120.657 -0.417 . . . . 0.0 111.161 -178.023 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -80.97 -40.78 23.87 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.745 0.307 . . . . 0.0 111.656 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -90.71 -46.54 8.19 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -171.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.594 ' HB2' HD12 ' A' 3595 ' ' LEU . 9.5 m-85 -98.34 -50.01 4.48 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.719 0.295 . . . . 0.0 111.323 -174.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.821 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 25.6 mm -60.66 -55.03 27.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.721 -177.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 73.3 m -56.27 -39.79 73.18 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 123.295 0.372 . . . . 0.0 110.977 179.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.79 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -66.68 -57.65 6.73 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.063 179.008 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.79 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.93 -41.25 77.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 111.54 0.2 . . . . 0.0 111.54 -177.704 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -37.1 67.39 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.698 -177.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.16 -33.88 72.32 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.973 0.416 . . . . 0.0 110.848 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -81.16 -19.04 44.26 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.837 178.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . 0.452 ' O ' ' HG ' ' A' 3555 ' ' LEU . 89.8 mt-30 46.31 61.32 2.79 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 121.376 0.608 . . . . 0.0 109.582 -168.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.503 ' O ' HD12 ' A' 3603 ' ' LEU . . . -137.84 -177.68 4.92 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.588 -173.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.691 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -118.19 117.89 30.37 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.212 173.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.02 101.14 0.45 Allowed Glycine 0 C--O 1.223 -0.571 0 N-CA-C 111.221 -0.752 . . . . 0.0 111.221 177.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.709 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 31.4 mm -89.4 127.7 41.91 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.851 0 CA-C-O 121.264 0.554 . . . . 0.0 110.977 -173.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.693 HD13 ' HB3' ' A' 3547 ' ' LEU . 71.5 mt -128.7 105.1 12.59 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.025 -0.989 . . . . 0.0 109.961 177.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.575 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.6 m120 -81.0 116.84 21.16 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 172.574 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.44 HG21 ' HD3' ' A' 3539 ' ' PRO . 8.0 p -120.13 135.04 24.12 Favored Pre-proline 0 C--N 1.309 -1.16 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.42 -176.229 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -77.28 134.55 14.28 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.888 1.725 . . . . 0.0 111.612 174.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.538 ' HB3' ' HB2' ' A' 3619 ' ' SER . 0.2 OUTLIER -58.78 114.66 9.45 Favored Pre-proline 0 C--N 1.32 -0.717 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.615 178.759 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . 0.575 ' HD2' ' O ' ' A' 3536 ' ' ARG . 6.0 Cg_endo -48.9 109.53 0.27 Allowed 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.2 2.6 . . . . 0.0 112.417 -178.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 102.18 -35.77 4.72 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.363 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . 0.538 ' HB2' ' HB3' ' A' 3616 ' ' ASN . 7.6 m -96.02 -18.42 20.24 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 120.78 0.324 . . . . 0.0 110.967 -177.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 5.4 t30 64.59 16.38 10.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 123.275 0.63 . . . . 0.0 111.522 176.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.433 ' HA ' ' HD3' ' A' 3622 ' ' PRO . 26.1 mt-30 -81.79 108.27 10.67 Favored Pre-proline 0 C--N 1.327 -0.403 0 O-C-N 122.326 -0.234 . . . . 0.0 110.404 -179.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' 3621 ' ' GLN . 19.7 Cg_endo -89.23 17.19 1.66 Allowed 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 123.121 2.548 . . . . 0.0 112.333 -177.209 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -81.98 41.57 0.67 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.009 -177.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.575 ' O ' ' HA ' ' A' 3613 ' ' ASN . 92.3 m-85 -127.88 132.39 49.36 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.833 178.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.424 HG13 HG23 ' A' 3611 ' ' ILE . 3.3 t -120.51 113.66 40.97 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.895 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.766 176.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.626 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.3 mp -94.98 112.25 23.97 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 171.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.458 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 36.8 mt-30 -93.99 110.71 22.38 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.299 -178.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.579 HG12 HG12 ' A' 3659 ' ' ILE . 48.0 mt -90.3 97.86 7.62 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.954 179.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -89.13 143.13 30.68 Favored Pre-proline 0 C--N 1.318 -0.789 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.823 179.04 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.53 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 48.5 Cg_endo -69.12 169.26 18.5 Favored 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.305 2.004 . . . . 0.0 111.039 175.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -68.64 55.16 0.85 Allowed 'Trans proline' 0 CA--C 1.533 0.443 0 C-N-CA 123.115 2.544 . . . . 0.0 112.433 177.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . 0.44 ' O ' ' HG2' ' A' 3636 ' ' GLU . 8.5 p -83.22 162.32 21.25 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.748 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -56.06 -42.3 76.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.355 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 19.9 t80 -60.41 -40.05 89.62 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 120.864 0.364 . . . . 0.0 110.272 179.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 12.4 t -61.33 -59.1 5.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.637 176.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' 3632 ' ' CYS . 7.9 mm-40 -65.19 -34.0 77.33 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.297 -173.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 30.6 t -65.25 -48.72 72.29 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-O 120.908 0.385 . . . . 0.0 110.264 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 7.3 m-70 -67.21 -32.02 72.8 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.353 178.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . 0.484 ' HB3' HD23 ' A' 3647 ' ' LEU . 65.0 mt -63.16 -40.32 97.22 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.899 175.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.63 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 38.0 m -63.83 -31.82 73.12 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.362 0.601 . . . . 0.0 110.153 178.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 19.5 tpp85 -80.11 -45.97 17.27 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.014 -179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.835 HD13 HD22 ' A' 3575 ' ' LEU . 19.5 mt -82.37 -35.0 28.18 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.564 -0.744 . . . . 0.0 112.449 -172.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.422 ' HB3' HG13 ' A' 3527 ' ' VAL . . . -147.86 82.57 7.83 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 120.86 0.362 . . . . 0.0 111.124 179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -66.23 -26.9 48.92 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.804 2.336 . . . . 0.0 113.377 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 8.0 t70 -75.34 -52.12 11.56 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.096 0.474 . . . . 0.0 110.197 -173.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.729 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -71.14 -29.31 65.07 Favored 'General case' 0 N--CA 1.439 -0.995 0 N-CA-C 108.921 -0.77 . . . . 0.0 108.921 179.598 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.63 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -55.26 -52.24 64.03 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 120.811 0.338 . . . . 0.0 110.622 178.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.79 -28.61 68.88 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.042 0.449 . . . . 0.0 110.682 -179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.445 ' HA ' HG21 ' A' 3496 ' ' VAL . 20.3 m -76.79 -35.19 57.8 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.114 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.582 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.4 pt -83.07 -9.92 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.413 -178.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.5 m -63.85 -16.38 61.21 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.214 0.53 . . . . 0.0 110.114 175.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 47.4 t30 -87.94 -38.72 15.34 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.904 173.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.582 HG22 ' HA ' ' A' 3650 ' ' ILE . 7.7 tp -105.25 41.08 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 CA-C-O 122.527 1.156 . . . . 0.0 109.66 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.474 ' N ' ' HD2' ' A' 3655 ' ' PRO . 14.7 m -38.05 -43.06 1.52 Allowed Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 114.008 -1.451 . . . . 0.0 113.747 172.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.474 ' HD2' ' N ' ' A' 3654 ' ' SER . 19.6 Cg_endo -61.27 77.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.359 1.094 0 C-N-CA 121.631 1.554 . . . . 0.0 111.818 169.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . 0.419 ' HB2' HD23 ' A' 3579 ' ' LEU . 25.9 p80 -142.82 174.61 10.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.981 -177.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.486 HD22 HG22 ' A' 3628 ' ' ILE . 36.9 mt -120.63 142.05 49.79 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.301 178.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 13.3 tmm? -105.84 109.64 21.66 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 176.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.827 HD12 HD21 ' A' 3524 ' ' LEU . 74.6 mt -105.38 119.05 53.92 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.264 0.554 . . . . 0.0 111.499 -171.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.768 HG13 ' HD2' ' A' 3573 ' ' TYR . 81.0 t -102.68 116.6 46.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.686 -179.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.635 HD11 HD11 ' A' 3576 ' ' LEU . 54.3 mt -90.53 111.86 24.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.49 128.14 56.34 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 120.97 0.414 . . . . 0.0 111.503 -177.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 8.5 m -74.06 142.11 45.69 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.714 171.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 84.1 t . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.418 -0.801 . . . . 0.0 109.612 175.452 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.555 ' CE2' ' HG3' ' A' 3553 ' ' MET . 1.5 m-85 . . . . . 0 N--CA 1.478 0.964 0 CA-C-O 120.538 0.208 . . . . 0.0 110.615 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.646 ' O ' ' HG2' ' A' 3551 ' ' GLN . 48.4 tt0 59.29 -175.6 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -177.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.403 ' H ' ' HG2' ' B' 2519 ' ' GLU . 6.2 p -140.59 123.83 16.71 Favored 'General case' 0 C--N 1.317 -0.831 0 O-C-N 121.795 -0.566 . . . . 0.0 110.211 178.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.677 ' HG ' ' N ' ' B' 2522 ' ' SEP . 20.7 tp -88.82 -130.37 0.08 Allowed 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.245 177.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.677 ' N ' ' HG ' ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 18.3 t70 -155.84 -73.28 0.11 Allowed 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 179.249 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 . . . . . 0 C--O 1.247 0.969 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.522 -174.089 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.707 ' HA ' ' HA ' ' A' 3649 ' ' SER . 10.2 p . . . . . 0 N--CA 1.481 1.111 0 CA-C-O 121.789 0.804 . . . . 0.0 110.837 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . 0.456 ' OD2' ' HB ' ' A' 3499 ' ' VAL . 25.7 t70 -107.13 126.56 52.54 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.928 -176.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 77.8 mtp -74.49 -27.99 60.8 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.345 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.477 ' HA ' HD12 ' A' 3502 ' ' LEU . 27.4 t -66.92 -24.8 33.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.42 0.629 . . . . 0.0 110.447 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -72.86 -58.93 2.97 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.096 174.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.612 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.2 pp -69.94 -33.01 71.57 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -168.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.611 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.85 -15.46 62.64 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 120.049 -0.661 . . . . 0.0 110.023 -174.258 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.611 ' N ' HD13 ' A' 3502 ' ' LEU . 26.8 tptp -66.77 -33.53 75.83 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.882 176.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.409 ' HB3' ' CD2' ' A' 3505 ' ' TYR . 22.0 mttp -98.73 -43.72 6.68 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-O 121.141 0.496 . . . . 0.0 110.849 178.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.747 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -143.75 97.01 5.49 Favored Pre-proline 0 N--CA 1.441 -0.891 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.379 -176.489 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -81.85 174.17 10.51 Favored 'Trans proline' 0 CA--C 1.53 0.307 0 C-N-CA 124.045 3.163 . . . . 0.0 113.533 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.463 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 74.3 mt -71.33 135.79 27.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.647 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.44 HG13 ' HB2' ' A' 3526 ' ' PHE . 32.8 m -109.04 -24.39 4.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.927 -176.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.716 ' HE3' HD12 ' A' 3524 ' ' LEU . 34.6 t90 -151.3 153.72 35.37 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.673 0.273 . . . . 0.0 110.362 -176.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -150.92 119.76 6.61 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 176.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -176.32 -134.02 1.88 Allowed Glycine 0 N--CA 1.445 -0.751 0 N-CA-C 110.943 -0.863 . . . . 0.0 110.943 -178.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.626 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -136.32 154.45 50.86 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.194 0.521 . . . . 0.0 111.334 178.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.483 HD23 ' HB2' ' A' 3547 ' ' LEU . 78.1 mt -107.45 152.76 23.78 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 170.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.696 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -148.29 123.64 10.29 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.12 0.415 . . . . 0.0 112.12 -177.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.614 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.81 143.46 38.91 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 173.117 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.614 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.4 OUTLIER 62.87 -94.97 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 -169.294 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -142.91 10.44 1.77 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 173.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.509 ' O ' ' HA ' ' A' 3514 ' ' ALA . 62.2 m-20 -91.88 128.31 37.68 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.55 -174.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.406 HG22 ' HB2' ' A' 3514 ' ' ALA . 11.9 p -119.13 137.74 53.38 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.337 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -137.26 118.69 14.75 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.458 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.626 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.96 124.84 26.25 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 177.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 29.5 m -134.4 147.61 29.99 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 CA-C-O 121.609 0.718 . . . . 0.0 111.862 -175.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . 0.54 ' HG2' ' HB3' ' A' 3581 ' ' CYS . 9.1 pt20 -111.47 125.61 54.08 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.023 -0.99 . . . . 0.0 108.709 171.291 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.83 HD21 HD12 ' A' 3659 ' ' ILE . 2.2 mt -93.29 111.68 23.39 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.86 -175.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.463 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 68.2 m-70 -85.05 138.01 32.7 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.209 -0.905 . . . . 0.0 108.897 174.014 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.747 ' O ' ' HB2' ' A' 3505 ' ' TYR . 66.0 t80 -67.59 141.15 56.89 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 173.252 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.587 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.9 t -115.7 -54.91 4.38 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 121.387 0.613 . . . . 0.0 110.764 174.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.47 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 68.5 m -160.69 172.01 17.85 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.786 -171.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' 3570 ' ' GLU . . . 89.33 -151.11 21.75 Favored Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.575 -0.821 . . . . 0.0 112.298 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.565 ' HB2' ' HA ' ' A' 3571 ' ' THR . 39.7 t30 -108.26 117.6 34.58 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.597 0.237 . . . . 0.0 110.5 179.212 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.2 p30 -62.69 -29.14 70.43 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.4 -176.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . 0.434 ' HB ' HD21 ' A' 3530 ' ' ASN . 60.2 t -57.93 -34.75 49.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.37 179.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.423 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 34.2 mt -59.11 -46.22 88.88 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.928 177.348 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.466 ' HB1' HD12 ' A' 3538 ' ' LEU . . . -66.36 -41.34 89.63 Favored 'General case' 0 C--O 1.222 -0.383 0 CA-C-O 120.84 0.352 . . . . 0.0 110.474 -177.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 27.8 m-70 -60.43 -39.18 86.51 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.356 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -89.01 -17.74 28.78 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -177.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.487 ' HB2' HD11 ' A' 3626 ' ' LEU . 51.0 p -93.28 -41.61 9.78 Favored 'General case' 0 C--N 1.328 -0.342 0 O-C-N 121.966 -0.459 . . . . 0.0 110.788 178.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.684 HD13 ' HB2' ' A' 3509 ' ' TRP . 21.4 mt -80.56 110.39 16.78 Favored Pre-proline 0 C--N 1.32 -0.677 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 -179.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -78.83 139.23 15.42 Favored 'Trans proline' 0 N--CA 1.456 -0.722 0 C-N-CA 122.554 2.169 . . . . 0.0 112.369 -176.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.488 ' CD1' ' HA3' ' A' 3544 ' ' GLY . 29.2 mt 48.17 -154.17 0.08 Allowed 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.546 -1.206 . . . . 0.0 111.742 177.759 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 67.3 m -159.76 -39.68 0.05 Allowed 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 114.509 -1.223 . . . . 0.0 109.017 165.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -130.4 154.42 47.72 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.455 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 66.32 37.17 92.6 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.228 179.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . 0.488 ' HA3' ' CD1' ' A' 3540 ' ' LEU . . . -157.63 -178.03 31.3 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.68 -178.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.468 ' HA ' ' HD3' ' A' 3546 ' ' PRO . 72.1 Cg_endo -76.38 139.99 21.37 Favored 'Trans proline' 0 N--CA 1.462 -0.38 0 C-N-CA 122.939 2.426 . . . . 0.0 113.011 -178.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.468 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 21.5 Cg_exo -67.36 158.31 57.63 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.909 2.406 . . . . 0.0 111.616 173.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.678 ' HB3' HD13 ' A' 3612 ' ' ILE . 19.7 mt -69.04 109.23 3.88 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.263 177.52 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.696 ' HA ' ' O ' ' A' 3514 ' ' ALA . 18.5 ptt180 -90.98 144.49 25.62 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.81 0.338 . . . . 0.0 110.902 -178.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.435 HG22 HD22 ' B' 2521 ' ' LEU . 19.6 mt -99.19 110.93 27.48 Favored 'Isoleucine or valine' 0 C--O 1.246 0.874 0 CA-C-O 121.848 0.832 . . . . 0.0 111.12 -178.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.617 ' CB ' ' HA ' ' B' 2525 ' ' GLU . . . -117.42 5.92 12.57 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.281 -174.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.669 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 58.9 mt-30 -152.89 170.26 20.79 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.386 0.136 . . . . 0.0 110.935 177.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.714 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -153.18 139.29 18.3 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 120.744 0.307 . . . . 0.0 111.528 -177.609 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.609 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.7 tmm? -116.88 111.65 19.96 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.839 176.082 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 75.9 mtm-85 -61.07 111.03 1.53 Allowed 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 177.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.425 ' O ' HD12 ' A' 3555 ' ' LEU . 1.8 pp -68.53 98.34 0.86 Allowed 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 122.071 0.939 . . . . 0.0 109.545 -176.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.607 ' O ' ' HG ' ' A' 3560 ' ' LEU . 13.0 mm-40 -109.62 164.35 12.61 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.577 -1.192 . . . . 0.0 109.643 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -53.34 -51.39 62.57 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.884 0.373 . . . . 0.0 111.447 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 21.0 p -65.42 -36.56 84.29 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.982 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.499 ' O ' HG23 ' A' 3563 ' ' VAL . 16.0 mm100 -64.91 -37.83 88.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.753 178.093 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' 3556 ' ' GLU . 86.4 mt -64.85 -31.33 72.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.648 179.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -67.12 -44.25 80.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.206 0.527 . . . . 0.0 110.098 173.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -56.16 -45.46 87.72 Favored Glycine 0 CA--C 1.518 0.225 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.819 173.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.576 ' O ' ' HG2' ' A' 3566 ' ' ARG . 60.0 t -62.55 -43.63 98.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.852 0.358 . . . . 0.0 110.342 176.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -56.8 -39.87 74.92 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.26 179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.61 ' O ' ' HB ' ' A' 3568 ' ' THR . 45.8 ttt180 -58.33 -44.11 88.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.678 0.275 . . . . 0.0 111.469 -179.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . 0.576 ' HG2' ' O ' ' A' 3563 ' ' VAL . 5.7 ptp180 -76.69 -20.07 57.0 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.49 179.517 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.572 ' HG2' ' CE2' ' A' 3573 ' ' TYR . 81.3 mtp -84.61 -11.74 55.37 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 121.319 0.581 . . . . 0.0 109.964 175.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . 0.61 ' HB ' ' O ' ' A' 3565 ' ' ARG . 3.3 m -74.8 -23.93 58.57 Favored 'General case' 0 N--CA 1.436 -1.146 0 CA-C-N 115.311 -0.859 . . . . 0.0 110.171 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 60.6 t -126.58 101.27 7.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.257 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . 0.438 ' HB3' ' HA2' ' A' 3529 ' ' GLY . 44.9 mt-10 -75.72 109.0 8.95 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 178.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.565 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.2 m 148.55 -38.63 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.646 1.578 . . . . 0.0 107.287 -172.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.85 -27.53 40.12 Favored 'General case' 0 CA--C 1.514 -0.41 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.238 176.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.746 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -131.36 164.0 26.63 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.064 176.237 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.641 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 47.7 t -127.74 135.43 50.13 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 171.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.731 HD22 HD13 ' A' 3642 ' ' LEU . 13.6 tp -104.67 125.66 51.0 Favored 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.578 HD11 HD11 ' A' 3661 ' ' ILE . 64.5 mt -126.18 158.2 36.2 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.245 0.545 . . . . 0.0 111.217 -176.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.54 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -126.13 107.93 10.86 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.045 -0.979 . . . . 0.0 108.699 178.79 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.508 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.83 123.04 38.06 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.251 0.548 . . . . 0.0 110.626 -177.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.438 HD21 HG22 ' A' 3650 ' ' ILE . 83.4 mt -123.02 142.56 38.48 Favored Pre-proline 0 C--N 1.322 -0.614 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.299 -179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . 0.412 ' HA ' ' O ' ' A' 3521 ' ' ALA . 19.7 Cg_endo -61.87 112.11 1.4 Allowed 'Trans proline' 0 C--O 1.234 0.312 0 C-N-CA 122.382 2.055 . . . . 0.0 111.835 178.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . 0.54 ' HB3' ' HG2' ' A' 3523 ' ' GLN . 28.9 p -98.7 120.25 38.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.005 -179.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . 0.469 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -97.52 142.69 16.29 Favored Glycine 0 N--CA 1.439 -1.111 0 C-N-CA 120.259 -0.972 . . . . 0.0 112.536 -178.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 45.2 mtt85 -66.32 -31.42 72.2 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.037 0.922 . . . . 0.0 109.041 175.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.577 ' O ' HG23 ' A' 3588 ' ' VAL . 28.7 t70 -144.93 170.04 16.91 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.062 -1.426 . . . . 0.0 107.739 176.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -56.5 -38.11 71.31 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 118.203 0.456 . . . . 0.0 110.347 177.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -61.05 -46.72 89.54 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.383 0.611 . . . . 0.0 109.765 176.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.598 ' O ' ' HG2' ' A' 3591 ' ' GLN . 6.2 t70 -60.5 -44.75 95.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.173 179.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' 3584 ' ' ASP . 86.9 t -52.18 -41.37 33.15 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 115.807 -0.633 . . . . 0.0 111.104 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . 0.447 ' O ' ' HG2' ' A' 3593 ' ' GLU . 3.6 t -63.82 -52.32 58.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 121.685 0.755 . . . . 0.0 109.399 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 71.6 m -58.22 -43.83 87.91 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.116 -1.402 . . . . 0.0 111.977 -179.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . 0.598 ' HG2' ' O ' ' A' 3587 ' ' ASP . 18.1 mm-40 -68.61 -41.31 79.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.038 -177.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 83.2 m -61.45 -52.42 64.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.095 -178.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.1 pt-20 -67.23 -32.75 74.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.288 -178.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 28.1 t -64.78 -46.38 82.35 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 176.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.557 HD12 ' HB2' ' A' 3599 ' ' PHE . 52.0 tp -63.76 -46.2 86.35 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.231 -178.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.79 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.7 -29.26 69.78 Favored 'General case' 0 C--N 1.333 -0.118 0 C-N-CA 120.942 -0.303 . . . . 0.0 111.493 -175.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . 0.457 ' O ' ' HB ' ' A' 3601 ' ' THR . . . -85.91 -42.38 14.13 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.908 0.385 . . . . 0.0 111.256 179.132 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.426 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -85.24 -45.85 11.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -170.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.557 ' HB2' HD12 ' A' 3595 ' ' LEU . 15.1 m-85 -99.34 -50.41 4.12 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 120.704 0.288 . . . . 0.0 111.18 -176.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.79 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 26.3 mm -61.38 -55.78 22.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.066 -176.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . 0.457 ' HB ' ' O ' ' A' 3597 ' ' ALA . 74.4 m -60.43 -38.27 83.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.687 0.28 . . . . 0.0 111.221 -179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.775 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -67.05 -55.84 12.64 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.742 -0.208 . . . . 0.0 110.687 178.336 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.775 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.82 -41.98 78.8 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 111.606 0.224 . . . . 0.0 111.606 -178.354 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -70.74 -37.81 73.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.539 -0.3 . . . . 0.0 110.594 -177.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.13 -38.53 82.3 Favored 'General case' 0 CA--C 1.52 -0.184 0 CA-C-O 121.085 0.469 . . . . 0.0 110.626 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . 0.427 ' HG2' ' O ' ' A' 3602 ' ' TYR . 69.6 mmtt -77.5 -19.43 55.88 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.482 178.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 49.9 49.94 19.34 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.625 -169.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.523 ' O ' HD12 ' A' 3603 ' ' LEU . . . -128.5 -175.48 3.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.362 0.601 . . . . 0.0 112.169 -171.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.714 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.67 117.82 29.28 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-N 114.828 -1.078 . . . . 0.0 109.239 175.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.02 102.55 0.59 Allowed Glycine 0 C--O 1.221 -0.666 0 N-CA-C 111.008 -0.837 . . . . 0.0 111.008 176.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.669 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.3 mm -89.21 121.4 39.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 121.204 0.526 . . . . 0.0 110.84 -174.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.678 HD13 ' HB3' ' A' 3547 ' ' LEU . 57.6 mt -117.87 105.38 17.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.874 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.444 175.139 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -87.41 115.32 24.74 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 115.552 -0.749 . . . . 0.0 109.867 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 3.3 p -119.63 126.98 26.67 Favored Pre-proline 0 C--N 1.314 -0.939 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.583 -177.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.499 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 47.4 Cg_endo -70.35 138.73 36.6 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.296 1.997 . . . . 0.0 111.95 177.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.699 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 53.1 t30 -63.08 116.34 24.07 Favored Pre-proline 0 C--N 1.322 -0.608 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.407 179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . 0.451 ' HD2' ' HA ' ' A' 3616 ' ' ASN . 10.5 Cg_endo -54.01 108.86 0.31 Allowed 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.152 2.568 . . . . 0.0 112.33 -177.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 115.09 -32.25 5.87 Favored Glycine 0 N--CA 1.444 -0.788 0 CA-C-N 115.58 -0.737 . . . . 0.0 112.1 179.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 15.6 m -106.6 -22.21 12.83 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.754 0.311 . . . . 0.0 110.907 -179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 12.2 t-20 66.76 11.61 8.34 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.336 178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . . . . . . . . . 16.3 mm100 -80.62 116.8 64.53 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 109.979 -0.378 . . . . 0.0 109.979 178.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.499 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 88.0 Cg_endo -77.3 25.87 0.47 Allowed 'Trans proline' 0 C--N 1.342 0.231 0 C-N-CA 123.598 2.865 . . . . 0.0 113.033 -176.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -73.87 27.4 0.07 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -174.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.699 ' HE2' ' HB2' ' A' 3616 ' ' ASN . 85.5 m-85 -123.15 132.16 53.96 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.134 0.492 . . . . 0.0 110.58 178.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 4.2 t -124.84 117.27 49.74 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-N 115.099 -0.955 . . . . 0.0 110.003 178.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.631 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -98.17 112.25 24.29 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 170.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.485 ' HB3' ' HB1' ' A' 3609 ' ' ALA . 34.0 mt-30 -94.72 110.47 22.31 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.658 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.588 HG12 HG12 ' A' 3659 ' ' ILE . 38.7 mt -92.14 98.06 7.94 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.027 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . 0.63 ' HB2' ' HE3' ' A' 3658 ' ' MET . 97.5 m-85 -89.78 147.67 38.11 Favored Pre-proline 0 C--N 1.32 -0.7 0 CA-C-N 116.034 -0.53 . . . . 0.0 109.764 179.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.449 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.8 Cg_endo -70.35 171.02 15.91 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 122.364 2.043 . . . . 0.0 111.134 175.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.37 42.04 0.45 Allowed 'Trans proline' 0 CA--C 1.532 0.425 0 C-N-CA 123.025 2.483 . . . . 0.0 112.603 177.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 24.8 p -72.56 163.36 28.17 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.151 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -44.95 -47.97 11.37 Favored 'General case' 0 CA--C 1.532 0.252 0 O-C-N 123.721 0.638 . . . . 0.0 110.937 178.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 26.6 t80 -48.95 -55.43 11.88 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.653 178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . 0.49 ' HA ' ' HE2' ' A' 3658 ' ' MET . 19.7 m -56.58 -58.09 9.54 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.979 -177.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -60.81 -35.43 76.49 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.388 -174.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 66.4 m -57.34 -61.99 2.09 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.072 -178.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -69.83 -20.36 63.44 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.143 -178.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 62.8 mt -66.03 -35.97 81.99 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 120.924 -0.311 . . . . 0.0 110.364 174.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.803 ' HA ' HD22 ' A' 3647 ' ' LEU . 15.3 m -69.6 -35.31 75.17 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.321 0.581 . . . . 0.0 110.467 178.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -81.14 -37.79 28.26 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.629 -0.714 . . . . 0.0 111.058 -178.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.731 HD13 HD22 ' A' 3575 ' ' LEU . 15.7 mt -89.37 -31.11 17.93 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -174.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.433 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -153.0 72.53 7.11 Favored Pre-proline 0 C--N 1.328 -0.346 0 N-CA-C 112.238 0.459 . . . . 0.0 112.238 -176.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . 0.627 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 50.3 Cg_endo -70.87 -17.17 32.73 Favored 'Trans proline' 0 N--CA 1.464 -0.257 0 C-N-CA 122.152 1.901 . . . . 0.0 111.856 177.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . 0.518 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 40.1 m-20 -72.73 -45.0 60.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.177 -177.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.612 ' HB2' HD13 ' A' 3501 ' ' LEU . 0.1 OUTLIER -83.09 -28.79 29.24 Favored 'General case' 0 N--CA 1.447 -0.616 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 176.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.803 HD22 ' HA ' ' A' 3640 ' ' SER . 22.4 tp -50.54 -47.05 57.8 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.546 178.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.15 -19.01 61.05 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.945 0.402 . . . . 0.0 111.705 -177.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.707 ' HA ' ' HA ' ' A' 3496 ' ' VAL . 36.6 m -89.69 -31.05 17.66 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.839 0.352 . . . . 0.0 110.824 178.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.546 ' HA ' HG22 ' A' 3653 ' ' ILE . 6.5 pt -85.83 -13.77 10.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.623 -178.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 47.4 m -59.48 -22.17 61.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.795 0.331 . . . . 0.0 111.222 175.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -88.02 -38.37 15.54 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.481 0.658 . . . . 0.0 109.758 174.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.568 HD12 ' HG2' ' A' 3655 ' ' PRO . 8.2 tp -105.26 42.4 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 122.288 1.042 . . . . 0.0 109.408 -178.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.486 ' N ' ' HD2' ' A' 3655 ' ' PRO . 42.0 m -40.37 -42.0 2.86 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 114.384 -1.28 . . . . 0.0 113.148 171.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.568 ' HG2' HD12 ' A' 3653 ' ' ILE . 11.2 Cg_endo -58.15 83.45 0.05 OUTLIER 'Trans proline' 0 C--N 1.357 1.006 0 C-N-CA 121.635 1.557 . . . . 0.0 111.404 167.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.0 p-80 -149.26 169.71 20.16 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.253 -177.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.52 HD22 HG22 ' A' 3628 ' ' ILE . 46.3 mt -117.57 132.83 56.46 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.581 -179.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . 0.63 ' HE3' ' HB2' ' A' 3629 ' ' PHE . 9.5 tmm? -99.61 109.82 22.3 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 177.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.83 HD12 HD21 ' A' 3524 ' ' LEU . 74.2 mt -107.31 121.48 60.23 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 CA-C-O 121.281 0.562 . . . . 0.0 111.566 -170.152 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.746 HG13 ' HD2' ' A' 3573 ' ' TYR . 91.8 t -104.56 113.8 42.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.727 -179.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.641 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 58.3 mt -91.02 115.53 30.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.829 177.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -124.47 132.51 53.49 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.834 -0.346 . . . . 0.0 111.622 -178.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 24.7 m -86.03 112.44 21.24 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 171.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.533 -178.65 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.609 ' CD1' ' HB2' ' A' 3553 ' ' MET . 57.0 m-85 . . . . . 0 N--CA 1.481 1.116 0 N-CA-C 111.95 0.352 . . . . 0.0 111.95 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.565 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.6 OUTLIER 56.13 -162.02 0.18 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.829 0.823 . . . . 0.0 111.848 176.69 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 25.7 m -146.32 117.88 8.02 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 114.613 -1.176 . . . . 0.0 108.032 168.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.59 ' HG ' ' N ' ' B' 2522 ' ' SEP . 24.4 tp -80.04 -130.15 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 119.906 -0.718 . . . . 0.0 110.042 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.59 ' N ' ' HG ' ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 12.4 t70 -177.77 -74.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.027 -1.442 . . . . 0.0 107.64 176.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . 0.455 ' O ' ' HB2' ' B' 2525 ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . 0.617 ' HA ' ' CB ' ' A' 3550 ' ' ALA . 29.9 tt0 . . . . . 0 C--O 1.245 0.821 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.197 174.265 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.402 ' CG1' ' HA ' ' A' 3649 ' ' SER . 21.8 m . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 121.073 0.463 . . . . 0.0 110.295 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -102.56 115.18 30.06 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.988 -175.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 4.2 mpp? -75.1 -10.9 59.9 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.306 0.574 . . . . 0.0 109.817 178.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 25.9 t -61.66 -21.56 25.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.889 176.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -83.3 -58.97 2.61 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.848 0.356 . . . . 0.0 110.898 177.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.587 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp -60.27 -32.29 71.03 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -172.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.592 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.37 -15.56 63.75 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 120.327 -0.549 . . . . 0.0 110.546 -174.065 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.592 ' N ' HD13 ' A' 3502 ' ' LEU . 13.7 mptt -57.41 -42.64 82.69 Favored 'General case' 0 CA--C 1.52 -0.189 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.212 173.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.477 ' HB3' ' CD2' ' A' 3505 ' ' TYR . 5.1 tmtm? -95.45 -38.6 10.39 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 -178.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.737 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -147.06 101.39 3.87 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-O 121.302 0.572 . . . . 0.0 111.629 -177.422 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -86.23 174.02 6.38 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 124.158 3.239 . . . . 0.0 113.723 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.48 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 88.2 mt -71.88 131.34 34.76 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.243 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 29.3 m -100.96 -28.82 3.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.466 -178.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.671 ' HE3' HD12 ' A' 3524 ' ' LEU . 14.0 t90 -153.11 155.05 36.05 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 110.229 -0.285 . . . . 0.0 110.229 -175.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -150.95 119.93 6.67 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.74 -130.52 1.23 Allowed Glycine 0 N--CA 1.442 -0.928 0 N-CA-C 111.216 -0.754 . . . . 0.0 111.216 -178.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.636 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -136.87 152.71 50.54 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.359 0.6 . . . . 0.0 111.437 178.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.48 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 72.6 mt -105.53 153.61 21.51 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 168.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.666 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -146.64 124.07 11.67 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -177.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.785 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.3 144.61 38.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 120.334 -0.546 . . . . 0.0 109.687 172.674 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.785 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.7 OUTLIER 59.36 -93.56 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 122.964 0.506 . . . . 0.0 110.293 -170.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 20.2 m120 -141.78 7.31 1.86 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.073 -0.512 . . . . 0.0 109.842 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -104.51 129.67 52.53 Favored 'General case' 0 CA--C 1.515 -0.399 0 CA-C-O 121.115 0.484 . . . . 0.0 111.205 -177.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.613 HG22 ' HB2' ' A' 3514 ' ' ALA . 18.0 p -108.96 154.81 21.64 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.509 176.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -143.97 113.49 7.03 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.776 175.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.636 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.52 115.87 10.2 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.115 0.483 . . . . 0.0 110.059 177.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 28.0 m -129.67 147.77 33.26 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.582 0.706 . . . . 0.0 111.795 -176.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . 0.428 ' HG2' ' HB3' ' A' 3581 ' ' CYS . 3.8 pt20 -108.59 125.73 52.16 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.021 -0.99 . . . . 0.0 108.861 172.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.879 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -93.07 111.37 22.98 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-O 121.421 0.629 . . . . 0.0 111.716 -175.957 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.48 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 70.2 m-70 -87.65 136.56 32.9 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.878 -1.055 . . . . 0.0 108.595 175.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.737 ' O ' ' HB2' ' A' 3505 ' ' TYR . 63.9 t80 -64.77 141.09 58.89 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 174.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.589 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.1 t -115.3 -58.36 3.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 CA-C-O 121.386 0.612 . . . . 0.0 110.64 174.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.502 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 58.3 m -160.74 171.66 18.44 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.197 -171.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.59 -149.0 20.29 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.516 -0.849 . . . . 0.0 112.609 178.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.563 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.0 t-20 -101.6 111.54 23.81 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.599 0.237 . . . . 0.0 110.494 -179.188 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.6 p30 -61.15 -31.7 71.42 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.589 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 23.6 t -63.16 -32.3 55.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.508 -178.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.565 HD23 ' HD3' ' A' 3536 ' ' ARG . 28.8 mt -57.59 -39.44 76.81 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.086 177.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.473 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -67.38 -46.85 72.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.921 0.391 . . . . 0.0 110.297 179.288 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 8.1 t-160 -63.58 -27.66 69.4 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.286 -178.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.565 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.8 ptm180 -90.32 -14.92 32.18 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.452 ' O ' HG21 ' A' 3614 ' ' VAL . 21.7 p -103.78 -38.23 7.14 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.854 0.359 . . . . 0.0 111.949 -179.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.635 HD13 ' HB2' ' A' 3509 ' ' TRP . 19.4 mt -79.98 121.04 81.63 Favored Pre-proline 0 C--N 1.317 -0.815 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -175.063 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . 0.613 ' HB2' ' HG2' ' A' 3545 ' ' PRO . 6.6 Cg_endo -74.74 126.97 10.49 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.592 2.194 . . . . 0.0 113.667 -173.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 1.2 pt? -146.41 -163.92 1.86 Allowed 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 114.651 -1.159 . . . . 0.0 109.402 177.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 40.3 m 78.51 -22.67 0.27 Allowed 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 123.578 0.751 . . . . 0.0 111.899 174.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -139.56 91.83 2.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.29 0.566 . . . . 0.0 111.217 -179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 70.66 -67.07 0.79 Allowed Glycine 0 CA--C 1.517 0.214 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.852 -179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 120.63 71.88 0.32 Allowed Glycine 0 N--CA 1.446 -0.656 0 N-CA-C 111.831 -0.508 . . . . 0.0 111.831 -178.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.613 ' HG2' ' HB2' ' A' 3539 ' ' PRO . 27.9 Cg_endo -63.76 127.48 19.74 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.421 2.081 . . . . 0.0 111.711 179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 16.4 Cg_exo -66.42 145.52 77.41 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.608 2.206 . . . . 0.0 112.018 -178.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.666 ' HB3' HD13 ' A' 3612 ' ' ILE . 56.6 mt -74.09 112.25 10.04 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.932 177.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.666 ' HA ' ' O ' ' A' 3514 ' ' ALA . 16.2 ptt-85 -103.16 142.52 34.01 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.149 0.499 . . . . 0.0 111.003 -176.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.483 HG22 HD12 ' B' 2521 ' ' LEU . 33.2 mt -95.86 108.76 21.58 Favored 'Isoleucine or valine' 0 C--O 1.245 0.855 0 CA-C-O 121.878 0.847 . . . . 0.0 112.016 -171.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.496 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.3 -1.28 15.17 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.966 -176.082 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.673 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 41.6 mt-30 -149.95 170.66 18.31 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.423 0.154 . . . . 0.0 111.038 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.719 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.14 141.21 17.34 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.934 0.397 . . . . 0.0 111.193 -179.68 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.601 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -110.6 121.39 45.2 Favored 'General case' 0 C--O 1.221 -0.446 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.402 178.239 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 4.0 mmt-85 -63.34 110.68 1.99 Allowed 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.612 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -70.16 99.54 1.51 Allowed 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 122.152 0.977 . . . . 0.0 109.791 -178.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.597 ' O ' ' HG ' ' A' 3560 ' ' LEU . 38.5 mt-10 -112.91 160.08 18.42 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 114.634 -1.166 . . . . 0.0 109.659 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.607 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -52.53 -52.36 55.12 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 123.414 0.446 . . . . 0.0 111.202 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 7.0 p -58.85 -42.38 89.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.42 179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.547 ' O ' HG23 ' A' 3563 ' ' VAL . 23.2 mm-40 -62.1 -48.07 81.81 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.035 177.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.597 ' HG ' ' O ' ' A' 3556 ' ' GLU . 87.0 mt -61.05 -34.46 74.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.404 -177.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.607 ' HG2' ' O ' ' A' 3557 ' ' ALA . 29.6 mm-40 -59.38 -51.89 67.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.174 0.511 . . . . 0.0 109.878 175.635 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.31 -38.89 96.44 Favored Glycine 0 N--CA 1.451 -0.335 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.312 178.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.547 HG23 ' O ' ' A' 3559 ' ' GLN . 83.9 t -61.24 -56.39 18.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.535 0.207 . . . . 0.0 110.644 178.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . 0.404 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -65.23 -29.03 69.79 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 -175.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.416 ' NH1' ' HB3' ' A' 3561 ' ' GLU . 72.2 mtt180 -75.9 -22.83 55.69 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -178.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . 0.454 ' HG2' ' O ' ' A' 3563 ' ' VAL . 36.4 ptt180 -89.49 -12.32 40.4 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.009 -0.676 . . . . 0.0 109.669 169.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.536 ' HG3' ' O ' ' A' 3563 ' ' VAL . 78.1 mtp -81.72 -19.06 42.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.785 178.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 21.8 p -75.09 -19.23 60.06 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.408 0.623 . . . . 0.0 110.081 176.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.7 t -95.93 79.52 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.002 177.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -67.65 108.41 2.89 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 177.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.563 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 153.44 -43.24 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.52 1.528 . . . . 0.0 108.053 -175.179 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -81.25 -30.65 34.05 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.832 -179.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.718 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -125.69 165.31 18.83 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.172 -179.891 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.625 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 25.4 t -127.09 135.79 51.25 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 171.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.762 HD22 HD13 ' A' 3642 ' ' LEU . 13.9 tp -106.16 125.17 50.66 Favored 'General case' 0 C--N 1.311 -1.097 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 178.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.61 HD11 HD11 ' A' 3661 ' ' ILE . 79.1 mt -127.19 151.78 48.24 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.149 0.499 . . . . 0.0 110.755 -177.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.698 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.03 108.68 14.59 Favored 'General case' 0 N--CA 1.442 -0.831 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.356 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.512 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.39 122.4 36.92 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.304 0.573 . . . . 0.0 110.431 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.621 HD21 HG22 ' A' 3650 ' ' ILE . 82.5 mt -122.13 140.83 33.08 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.184 -179.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -60.88 112.72 1.44 Allowed 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.393 2.062 . . . . 0.0 111.819 178.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . 0.428 ' HB3' ' HG2' ' A' 3523 ' ' GLN . 25.7 p -99.75 118.47 36.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.116 0.484 . . . . 0.0 110.293 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . 0.429 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.33 145.57 16.26 Favored Glycine 0 N--CA 1.442 -0.948 0 C-N-CA 120.553 -0.832 . . . . 0.0 112.652 -178.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 38.8 mtm180 -76.87 -31.23 56.66 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.907 0.86 . . . . 0.0 109.353 177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.562 ' H ' ' HB3' ' A' 3587 ' ' ASP . 22.8 t70 -134.47 167.66 20.36 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.249 -1.341 . . . . 0.0 108.346 -178.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 7.8 tp60 -54.6 -43.55 72.28 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.005 0.431 . . . . 0.0 110.348 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -70.32 -33.68 71.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.176 178.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.562 ' HB3' ' H ' ' A' 3584 ' ' ASP . 6.8 t70 -64.93 -42.77 94.39 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' 3584 ' ' ASP . 93.8 t -56.28 -50.96 68.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.185 0 CA-C-N 115.137 -0.938 . . . . 0.0 110.202 176.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 75.1 t -58.21 -50.51 78.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.695 178.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 42.1 t -55.43 -51.12 67.92 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.319 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 26.6 mm-40 -65.73 -36.98 85.13 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 121.22 -0.192 . . . . 0.0 111.225 -177.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . 0.446 ' O ' ' HB3' ' A' 3596 ' ' LYS . 49.2 m -64.41 -44.71 90.4 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.957 0.408 . . . . 0.0 110.181 176.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.453 ' HA ' ' CE ' ' A' 3596 ' ' LYS . 12.9 tp10 -61.01 -47.16 87.73 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.604 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 39.4 m -65.85 -47.72 73.99 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.047 -179.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.554 HD12 ' HB2' ' A' 3599 ' ' PHE . 59.6 tp -59.5 -44.15 93.16 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.87 0.367 . . . . 0.0 110.73 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.695 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.9 OUTLIER -62.59 -35.76 80.55 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.262 -178.033 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . 0.417 ' O ' ' HB ' ' A' 3601 ' ' THR . . . -83.59 -41.18 18.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.728 0.299 . . . . 0.0 111.725 -178.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.494 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -86.57 -46.27 10.29 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -170.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.554 ' HB2' HD12 ' A' 3595 ' ' LEU . 19.6 m-85 -99.45 -50.5 4.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.711 0.291 . . . . 0.0 111.166 -175.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.695 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.2 mm -60.88 -57.01 14.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.664 -176.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . 0.417 ' HB ' ' O ' ' A' 3597 ' ' ALA . 91.7 m -56.29 -49.11 75.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.022 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.663 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -59.52 -57.33 13.44 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.158 -179.489 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.663 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.3 OUTLIER -55.83 -42.28 75.49 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -178.52 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 4.7 pp0? -75.85 -40.03 55.49 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 120.573 -0.451 . . . . 0.0 110.848 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -66.1 -46.43 77.64 Favored 'General case' 0 CA--C 1.519 -0.212 0 CA-C-O 120.988 0.423 . . . . 0.0 110.97 -178.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 22.2 mmmt -77.74 -11.59 59.89 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.281 -178.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 50.36 63.22 2.29 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.893 -0.594 . . . . 0.0 110.255 -174.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.558 ' O ' HD12 ' A' 3603 ' ' LEU . . . -138.35 -176.28 4.4 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.213 0.53 . . . . 0.0 112.317 -173.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.719 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -122.89 117.78 26.37 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.023 -0.989 . . . . 0.0 109.33 174.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . 0.449 ' N ' HD11 ' A' 3603 ' ' LEU . . . -64.36 103.7 0.78 Allowed Glycine 0 C--O 1.222 -0.621 0 C-N-CA 120.851 -0.69 . . . . 0.0 111.499 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.673 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 28.8 mm -89.42 124.33 42.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 CA-C-O 121.212 0.53 . . . . 0.0 110.659 -175.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.666 HD13 ' HB3' ' A' 3547 ' ' LEU . 62.1 mt -124.2 105.99 16.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.863 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.108 177.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.51 ' HA ' ' O ' ' A' 3624 ' ' TYR . 7.1 m120 -80.77 112.31 18.03 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.452 HG21 ' O ' ' A' 3537 ' ' SER . 6.2 p -113.58 127.58 26.66 Favored Pre-proline 0 C--N 1.311 -1.068 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.815 -177.368 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.574 ' HB2' ' HA ' ' A' 3620 ' ' ASN . 79.2 Cg_endo -83.12 136.8 8.1 Favored 'Trans proline' 0 N--CA 1.448 -1.193 0 C-N-CA 122.38 2.053 . . . . 0.0 111.808 173.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.421 ' HA ' ' HD3' ' A' 3617 ' ' PRO . 8.5 p30 -62.72 115.88 19.91 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.028 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' 3616 ' ' ASN . 77.8 Cg_exo -49.94 123.87 11.57 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 123.367 2.711 . . . . 0.0 112.821 -174.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 109.42 -50.99 0.73 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.986 -0.626 . . . . 0.0 112.003 179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 1.7 p -97.27 -25.81 15.13 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.822 0.344 . . . . 0.0 110.99 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . 0.574 ' HA ' ' HB2' ' A' 3615 ' ' PRO . 21.4 t-20 59.75 72.61 0.52 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.579 177.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.573 ' O ' ' HA ' ' A' 3615 ' ' PRO . 94.5 mt-30 -127.0 109.27 21.86 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.126 171.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -76.63 24.5 0.46 Allowed 'Trans proline' 0 C--O 1.234 0.321 0 C-N-CA 123.413 2.742 . . . . 0.0 113.606 -173.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -75.99 47.47 0.44 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.87 0.367 . . . . 0.0 111.914 -178.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.51 ' O ' ' HA ' ' A' 3613 ' ' ASN . 78.7 m-85 -141.34 133.53 27.93 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.373 176.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . . . . . . . . . 20.1 t -116.1 114.98 47.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.935 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.599 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -99.45 115.44 29.28 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 168.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.501 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 97.9 mt-30 -94.66 111.32 23.09 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.04 179.228 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.594 HG12 HG12 ' A' 3659 ' ' ILE . 43.9 mt -90.46 98.46 8.31 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.952 0 CA-C-N 116.063 -0.517 . . . . 0.0 109.961 178.096 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -88.48 145.04 34.66 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.085 178.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.558 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.3 Cg_endo -69.91 172.84 12.04 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 122.744 2.296 . . . . 0.0 111.901 177.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 50.8 Cg_endo -70.88 46.69 0.66 Allowed 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 122.97 2.447 . . . . 0.0 112.272 175.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.5 p -80.66 162.63 24.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.276 -177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . 0.41 ' CD ' ' H ' ' A' 3633 ' ' GLU . 3.3 mp0 -53.73 -38.96 64.86 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.012 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 32.0 t80 -49.69 -50.04 45.26 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-O 121.284 0.564 . . . . 0.0 110.95 174.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 4.1 m -64.95 -52.9 53.77 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.336 -0.847 . . . . 0.0 110.153 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -52.19 -50.65 61.48 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.143 -176.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 51.3 p -60.56 -50.45 73.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.174 0.512 . . . . 0.0 110.711 -175.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 72.1 m80 -66.3 -36.24 82.45 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.975 -179.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 76.4 mt -64.29 -34.67 78.66 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.052 176.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.989 ' HA ' HD22 ' A' 3647 ' ' LEU . 34.8 m -64.12 -37.1 86.23 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.224 0.535 . . . . 0.0 110.412 -179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.82 -51.11 9.57 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.202 178.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.762 HD13 HD22 ' A' 3575 ' ' LEU . 30.1 mt -72.45 -34.39 67.75 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.628 -0.714 . . . . 0.0 112.789 -171.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.422 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -151.35 84.39 5.22 Favored Pre-proline 0 C--N 1.328 -0.334 0 N-CA-C 111.875 0.324 . . . . 0.0 111.875 -179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -73.52 -23.12 17.56 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 122.6 2.2 . . . . 0.0 113.372 -177.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 12.3 t0 -76.46 -52.91 8.91 Favored 'General case' 0 CA--C 1.515 -0.365 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 -175.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.698 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -69.79 -28.32 65.64 Favored 'General case' 0 N--CA 1.439 -0.988 0 N-CA-C 108.439 -0.949 . . . . 0.0 108.439 178.625 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.989 HD22 ' HA ' ' A' 3640 ' ' SER . 31.7 tp -51.12 -50.13 59.45 Favored 'General case' 0 CA--C 1.522 -0.098 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.914 174.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.33 -23.75 65.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.179 -178.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.402 ' HA ' ' CG1' ' A' 3496 ' ' VAL . 12.9 m -83.43 -36.38 24.26 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.436 179.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.621 HG22 HD21 ' A' 3579 ' ' LEU . 4.3 pt -81.31 -17.28 12.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.487 -177.09 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 49.6 m -58.44 -22.55 54.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.957 0.408 . . . . 0.0 110.91 175.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . 0.424 HD22 ' N ' ' A' 3652 ' ' ASN . 0.9 OUTLIER -89.28 -37.09 15.19 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 121.016 0.436 . . . . 0.0 110.787 174.454 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.582 HG22 ' HA ' ' A' 3650 ' ' ILE . 7.5 tp -104.51 39.76 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 122.473 1.13 . . . . 0.0 109.307 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.464 ' N ' ' HD2' ' A' 3655 ' ' PRO . 20.2 m -35.53 -44.57 0.84 Allowed Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 113.784 -1.553 . . . . 0.0 114.038 173.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' 3654 ' ' SER . 20.2 Cg_endo -62.46 76.12 0.1 Allowed 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 121.541 1.494 . . . . 0.0 112.008 171.199 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 34.6 p80 -145.65 175.47 10.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.121 -179.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.478 HD22 HG22 ' A' 3628 ' ' ILE . 21.6 mt -120.6 152.32 38.3 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.77 -177.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 57.4 ttp -112.0 109.51 19.31 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 174.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.879 HD12 HD21 ' A' 3524 ' ' LEU . 81.1 mt -102.67 116.63 46.72 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-O 121.317 0.58 . . . . 0.0 111.325 -172.538 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.718 HG13 ' HD2' ' A' 3573 ' ' TYR . 82.1 t -102.47 115.28 44.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.023 -178.19 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.625 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 64.3 mt -90.9 121.85 41.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -123.68 126.54 46.75 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.633 -0.427 . . . . 0.0 111.722 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.5 m -104.93 110.47 22.86 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.832 169.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 41.0 t . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.961 -0.542 . . . . 0.0 110.03 -178.276 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.601 ' CD1' ' HB2' ' A' 3553 ' ' MET . 31.9 m-85 . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.516 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.5 OUTLIER 54.22 -162.97 0.12 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 122.022 0.915 . . . . 0.0 112.16 177.318 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 1.2 p -144.25 116.72 8.58 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.096 -1.411 . . . . 0.0 108.225 167.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.608 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER -76.18 -133.13 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.905 -0.776 . . . . 0.0 108.905 -179.457 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.698 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 20.9 p-10 -97.66 -49.54 4.81 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.629 -0.714 . . . . 0.0 109.951 178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 2.7 mp0 . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.203 -0.903 . . . . 0.0 109.765 176.693 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.701 ' HA ' ' HB3' ' A' 3649 ' ' SER . 13.4 m . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 121.214 0.531 . . . . 0.0 110.318 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 20.8 t70 -88.65 113.6 24.38 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.939 -175.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . 0.454 ' O ' HD12 ' A' 3502 ' ' LEU . 1.9 mpp? -75.32 -23.77 57.34 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.742 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 39.6 t -65.71 -24.66 34.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.935 -176.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -81.08 -61.14 2.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.066 0.46 . . . . 0.0 110.679 175.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.512 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.1 pp -66.1 -31.37 72.2 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -171.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.64 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.76 -17.32 64.5 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 120.262 -0.575 . . . . 0.0 110.436 -174.107 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.64 ' N ' HD13 ' A' 3502 ' ' LEU . 22.8 tptm -68.42 -28.15 66.82 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.065 179.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.418 ' HD2' ' HA ' ' A' 3504 ' ' LYS . 32.0 tptt -103.17 -42.29 5.81 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.257 0.551 . . . . 0.0 109.894 179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.742 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -146.26 97.16 4.45 Favored Pre-proline 0 C--N 1.325 -0.496 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.553 -178.219 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -79.67 173.06 13.44 Favored 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 123.573 2.848 . . . . 0.0 113.524 -176.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.535 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.0 mt -73.0 137.2 23.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.132 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.44 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.5 m -105.11 -31.37 2.71 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.654 -178.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.773 ' HE3' HD12 ' A' 3524 ' ' LEU . 18.2 t90 -145.33 155.69 43.35 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.793 0.33 . . . . 0.0 110.825 -174.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -150.56 120.6 7.19 Favored 'General case' 0 C--N 1.319 -0.733 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 176.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -174.18 -132.32 1.53 Allowed Glycine 0 N--CA 1.444 -0.818 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 -178.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.639 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.4 mp -138.1 155.69 48.51 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.058 0.456 . . . . 0.0 110.989 178.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.534 HD23 ' HB2' ' A' 3547 ' ' LEU . 91.2 mt -109.03 146.15 34.41 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 169.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.708 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.37 126.84 16.82 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.465 0.174 . . . . 0.0 110.918 -179.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.785 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.53 141.4 39.32 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 172.619 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.785 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 62.85 -86.99 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.196 0.598 . . . . 0.0 109.908 -171.532 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . 0.403 HD22 ' HA ' ' A' 3517 ' ' ASN . 2.5 m120 -149.81 11.9 0.76 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.185 175.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.437 ' O ' ' HA ' ' A' 3514 ' ' ALA . 16.5 m-20 -103.0 139.4 38.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.607 -0.269 . . . . 0.0 110.358 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.522 HG22 ' HB2' ' A' 3514 ' ' ALA . 37.5 p -127.12 143.13 51.34 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.108 0.48 . . . . 0.0 111.71 -175.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -139.55 114.69 9.65 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.396 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.616 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -68.97 120.61 15.11 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 177.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.438 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 31.4 m -129.87 148.28 33.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-O 121.582 0.706 . . . . 0.0 112.181 -174.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -108.72 125.52 52.0 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 114.849 -1.068 . . . . 0.0 108.827 171.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.861 HD21 HD12 ' A' 3659 ' ' ILE . 2.1 mt -93.98 114.2 26.35 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.371 0.605 . . . . 0.0 111.637 -176.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.535 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 48.3 m80 -89.5 142.4 27.7 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.747 177.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.742 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.1 t80 -70.32 135.28 48.73 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 171.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.604 ' CG1' HD23 ' A' 3575 ' ' LEU . 24.3 t -114.33 -57.0 3.99 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.939 0 CA-C-O 121.467 0.651 . . . . 0.0 110.283 176.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.574 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 66.1 m -160.0 171.21 19.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.111 -172.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 86.3 -152.57 25.61 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.432 -0.89 . . . . 0.0 111.744 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.554 ' HB2' ' HA ' ' A' 3571 ' ' THR . 3.4 t-20 -102.13 117.76 35.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.115 0.458 . . . . 0.0 110.758 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -65.24 -28.56 69.44 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.176 -178.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . 0.4 ' HB ' ' OD1' ' A' 3530 ' ' ASN . 61.0 t -59.52 -33.13 50.59 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.477 178.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.57 HD23 ' HD3' ' A' 3536 ' ' ARG . 18.7 mt -58.94 -41.55 87.64 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.092 177.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.489 ' HB1' HD12 ' A' 3538 ' ' LEU . . . -69.23 -40.0 78.2 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.935 0.397 . . . . 0.0 110.361 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -65.45 -32.68 74.42 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.76 -179.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.57 ' HD3' HD23 ' A' 3533 ' ' LEU . 11.2 ptm180 -90.13 -11.63 40.64 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 -178.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . . . . . . . . . 26.7 p -104.12 -43.33 5.28 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.542 179.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.7 HD13 ' HB2' ' A' 3509 ' ' TRP . 35.8 mt -78.82 111.94 23.45 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-O 121.228 0.537 . . . . 0.0 110.033 -172.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . 0.513 ' HD3' HG21 ' A' 3614 ' ' VAL . 97.3 Cg_endo -85.26 168.91 10.1 Favored 'Trans proline' 0 N--CA 1.453 -0.891 0 C-N-CA 123.101 2.534 . . . . 0.0 112.793 -172.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.7 ' HA ' ' HG3' ' A' 3545 ' ' PRO . 3.8 pp -171.37 164.56 7.06 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.205 176.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 17.8 t -148.09 -42.55 0.16 Allowed 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 173.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -114.65 -158.9 0.68 Allowed 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.198 -0.91 . . . . 0.0 108.858 171.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . -75.62 59.29 2.93 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.953 -0.641 . . . . 0.0 113.581 -177.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 105.42 107.46 3.22 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.684 -0.769 . . . . 0.0 113.89 173.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.7 ' HG3' ' HA ' ' A' 3540 ' ' LEU . 68.7 Cg_endo -92.12 170.97 2.67 Favored 'Trans proline' 0 CA--C 1.533 0.452 0 C-N-CA 123.448 2.765 . . . . 0.0 111.74 170.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.639 ' HA ' ' O ' ' A' 3512 ' ' LEU . 19.6 Cg_endo -95.79 123.65 0.29 Allowed 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 122.976 2.45 . . . . 0.0 113.455 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.647 ' HB3' HD13 ' A' 3612 ' ' ILE . 26.7 mt -79.32 122.98 27.03 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.637 172.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.708 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -102.84 143.85 31.93 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.814 0.34 . . . . 0.0 111.816 -174.571 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.517 HG22 HD12 ' B' 2521 ' ' LEU . 21.8 mt -98.93 107.45 20.52 Favored 'Isoleucine or valine' 0 C--O 1.248 0.978 0 CA-C-O 122.251 1.024 . . . . 0.0 111.903 -174.055 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.539 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -114.79 1.96 14.26 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.063 -0.971 . . . . 0.0 111.972 -174.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.678 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 66.8 mt-30 -148.99 172.47 14.69 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.476 0.179 . . . . 0.0 111.209 178.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.739 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.75 139.91 15.53 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.082 0.468 . . . . 0.0 111.621 -179.273 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.69 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 19.4 ttt -108.17 125.46 51.65 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.352 -179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 15.0 mmt180 -64.0 111.25 2.43 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 177.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.568 ' O ' HD12 ' A' 3555 ' ' LEU . 3.2 pp -76.57 98.56 4.71 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 122.413 1.102 . . . . 0.0 109.476 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' 3560 ' ' LEU . 44.1 mt-10 -108.22 159.06 16.91 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.29 176.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . . . . . . . . . . . -58.64 -41.69 86.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.473 0.654 . . . . 0.0 109.277 175.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . 0.416 ' O ' ' HB2' ' A' 3561 ' ' GLU . 0.7 OUTLIER -62.27 -41.23 98.28 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.827 177.882 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.54 ' O ' HG23 ' A' 3563 ' ' VAL . 17.2 mm-40 -70.28 -41.53 73.27 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.698 -179.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' 3556 ' ' GLU . 85.4 mt -61.58 -35.31 77.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.501 178.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' 3558 ' ' THR . 45.2 mm-40 -55.28 -51.35 66.94 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.136 172.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.37 -44.39 98.11 Favored Glycine 0 CA--C 1.519 0.29 0 CA-C-N 115.329 -0.85 . . . . 0.0 112.432 178.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.54 HG23 ' O ' ' A' 3559 ' ' GLN . 57.3 t -59.54 -52.43 61.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.503 0.192 . . . . 0.0 110.616 179.01 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . 0.546 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.96 -32.25 71.79 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.026 0.441 . . . . 0.0 111.046 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.478 ' O ' HG22 ' A' 3568 ' ' THR . 41.8 ttp180 -63.06 -38.27 90.52 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.167 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . 0.463 HH22 ' HH ' ' B' 2518 ' ' TYR . 25.2 ptt180 -88.5 -10.86 47.54 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 120.899 -0.32 . . . . 0.0 111.282 175.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.546 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 65.0 mtp -80.14 -26.55 39.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.975 177.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . 0.478 HG22 ' O ' ' A' 3565 ' ' ARG . 8.5 t -74.73 -9.43 58.55 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.983 0.42 . . . . 0.0 110.834 -177.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 40.8 t -111.26 87.63 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.471 0 CA-C-O 121.302 0.572 . . . . 0.0 110.236 178.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -69.15 110.42 4.54 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.178 -179.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.554 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.6 m 150.94 -40.62 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 125.747 1.619 . . . . 0.0 107.825 -178.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -80.69 -30.83 36.41 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.629 -179.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.667 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -126.72 166.5 17.28 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.058 178.626 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.622 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 33.7 t -129.27 135.81 49.26 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 171.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.778 HD22 HD13 ' A' 3642 ' ' LEU . 9.4 tp -105.87 124.8 50.15 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.466 -0.939 . . . . 0.0 108.466 177.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.58 HD11 HD11 ' A' 3661 ' ' ILE . 80.9 mt -125.1 158.1 34.67 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.038 0.447 . . . . 0.0 110.888 -177.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.753 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -125.74 106.9 10.04 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.391 -179.365 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.51 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.61 123.64 38.17 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.324 0.583 . . . . 0.0 110.605 -177.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.473 HD23 ' HB2' ' A' 3656 ' ' HIS . 39.5 mt -126.42 145.05 51.49 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 114.706 -1.133 . . . . 0.0 109.912 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . 0.435 ' HA ' ' O ' ' A' 3521 ' ' ALA . 17.8 Cg_endo -60.23 111.38 0.99 Allowed 'Trans proline' 0 CA--C 1.53 0.299 0 C-N-CA 122.323 2.016 . . . . 0.0 112.079 177.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.1 p -96.5 113.22 24.78 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.16 0.505 . . . . 0.0 109.975 179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . 0.453 ' HA3' HG22 ' A' 3588 ' ' VAL . . . -96.36 146.15 18.13 Favored Glycine 0 N--CA 1.442 -0.964 0 C-N-CA 120.754 -0.736 . . . . 0.0 113.111 -175.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 4.2 mtm180 -73.31 -15.48 61.4 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.935 0.874 . . . . 0.0 109.417 177.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.643 ' O ' HG23 ' A' 3588 ' ' VAL . 16.7 t70 -158.35 167.03 30.81 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 114.113 -1.403 . . . . 0.0 107.22 177.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -58.62 -40.9 84.62 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 118.144 0.429 . . . . 0.0 110.47 179.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -65.51 -37.23 86.17 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.513 177.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.533 ' HB3' ' H ' ' A' 3584 ' ' ASP . 17.1 t70 -63.45 -44.26 95.02 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.813 -0.631 . . . . 0.0 109.769 178.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.643 HG23 ' O ' ' A' 3584 ' ' ASP . 58.1 t -54.1 -42.52 55.74 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.123 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.727 177.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 5.4 t -62.75 -49.27 84.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 121.629 0.728 . . . . 0.0 109.571 -178.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 55.8 m -62.74 -39.9 95.53 Favored 'General case' 0 N--CA 1.44 -0.97 0 CA-C-N 114.358 -1.292 . . . . 0.0 111.765 -179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . 0.484 HE21 ' HB3' ' A' 3521 ' ' ALA . 13.7 mm100 -70.56 -39.48 73.92 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.358 -0.214 . . . . 0.0 110.972 179.075 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 73.8 m -60.14 -50.32 74.16 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.842 0.353 . . . . 0.0 111.157 179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.537 ' HA ' ' HG2' ' A' 3596 ' ' LYS . 11.4 pt-20 -66.76 -30.89 71.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.166 -178.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 50.5 m -70.54 -40.47 73.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.089 0.471 . . . . 0.0 110.219 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.522 HD12 ' HB2' ' A' 3599 ' ' PHE . 59.5 tp -65.61 -46.16 80.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.09 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.793 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 19.9 ptmt -65.65 -34.39 78.11 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.809 -0.356 . . . . 0.0 111.256 -178.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -78.17 -39.19 41.59 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.671 0.272 . . . . 0.0 111.393 -179.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.49 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -91.05 -46.26 8.23 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.884 0.698 . . . . 0.0 112.884 -172.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.522 ' HB2' HD12 ' A' 3595 ' ' LEU . 19.1 m-85 -99.01 -50.37 4.2 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.774 0.321 . . . . 0.0 111.533 -174.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.793 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 23.2 mm -61.91 -58.13 8.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.067 -175.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 87.7 m -57.55 -42.54 83.19 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.147 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.797 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -62.43 -57.37 11.5 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 121.366 -0.133 . . . . 0.0 110.979 178.325 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.797 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.1 OUTLIER -57.13 -39.2 74.69 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.58 0.229 . . . . 0.0 111.466 -176.322 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -77.53 -38.13 49.38 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.748 -176.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.74 -35.56 75.08 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.966 0.413 . . . . 0.0 111.129 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . 0.445 ' HG2' ' O ' ' A' 3602 ' ' TYR . 27.1 mmmt -87.71 -9.09 55.09 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.931 179.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 47.33 63.45 1.97 Allowed 'General case' 0 C--O 1.235 0.328 0 O-C-N 123.764 0.665 . . . . 0.0 111.266 -177.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.561 ' O ' HD12 ' A' 3603 ' ' LEU . . . -143.23 -177.42 5.36 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.009 -0.541 . . . . 0.0 112.027 -175.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.739 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -116.04 118.25 32.37 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.164 173.685 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . 0.445 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.07 102.73 0.55 Allowed Glycine 0 C--O 1.223 -0.547 0 C-N-CA 120.718 -0.753 . . . . 0.0 111.343 178.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.678 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 28.6 mm -89.55 123.84 41.96 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.238 0.542 . . . . 0.0 110.795 -175.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.647 HD13 ' HB3' ' A' 3547 ' ' LEU . 53.8 mt -119.23 106.79 19.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.739 175.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.45 ' HA ' ' O ' ' A' 3624 ' ' TYR . 4.1 m120 -82.97 106.85 15.14 Favored 'General case' 0 CA--C 1.505 -0.762 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 175.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.513 HG21 ' HD3' ' A' 3539 ' ' PRO . 9.3 p -109.12 133.52 20.72 Favored Pre-proline 0 C--N 1.312 -1.058 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.143 -171.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.585 ' HB2' ' HA ' ' A' 3620 ' ' ASN . 71.8 Cg_endo -80.13 133.38 9.88 Favored 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 121.995 1.797 . . . . 0.0 111.612 171.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.425 ' HA ' ' HD2' ' A' 3617 ' ' PRO . 11.4 t-20 -55.09 123.07 46.06 Favored Pre-proline 0 C--N 1.32 -0.709 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.718 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' 3616 ' ' ASN . 11.5 Cg_endo -55.56 107.61 0.26 Allowed 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.391 2.061 . . . . 0.0 111.434 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 115.79 -48.21 0.96 Allowed Glycine 0 N--CA 1.443 -0.837 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.599 -177.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 5.7 m -96.82 -20.86 17.88 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.678 0.239 . . . . 0.0 111.171 -176.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . 0.585 ' HA ' ' HB2' ' A' 3615 ' ' PRO . 86.2 m-20 63.7 26.28 14.48 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.782 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.423 ' O ' ' HA ' ' A' 3615 ' ' PRO . 54.0 mt-30 -88.14 111.77 45.12 Favored Pre-proline 0 C--N 1.326 -0.436 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.065 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.458 ' HA ' ' O ' ' A' 3614 ' ' VAL . 85.7 Cg_endo -84.87 23.29 0.85 Allowed 'Trans proline' 0 C--O 1.233 0.269 0 C-N-CA 123.32 2.68 . . . . 0.0 113.565 -173.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -82.28 53.4 2.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.772 0.32 . . . . 0.0 111.449 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.45 ' O ' ' HA ' ' A' 3613 ' ' ASN . 79.0 m-85 -143.44 133.78 24.63 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.061 0.458 . . . . 0.0 110.52 178.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.455 HG13 HD12 ' A' 3611 ' ' ILE . 15.5 t -113.39 114.28 46.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.972 176.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.626 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.4 mp -100.41 113.44 26.2 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 170.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.483 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 14.3 mt-30 -94.68 110.38 22.22 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.647 -178.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.589 HG12 HG12 ' A' 3659 ' ' ILE . 40.5 mt -91.82 98.19 8.09 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.072 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.0 m-85 -88.58 141.71 30.49 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.297 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.649 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 57.2 Cg_endo -71.31 164.6 35.2 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 122.572 2.182 . . . . 0.0 111.504 176.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -67.26 85.86 0.33 Allowed 'Trans proline' 0 C--O 1.235 0.348 0 C-N-CA 122.799 2.333 . . . . 0.0 112.016 178.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . 0.55 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.1 p -112.4 162.12 15.92 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.375 -0.829 . . . . 0.0 110.002 -177.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 12.3 tp10 -55.74 -33.78 64.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.684 0.278 . . . . 0.0 110.305 179.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 8.1 t80 -67.97 -42.58 80.65 Favored 'General case' 0 C--O 1.241 0.622 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.084 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . 0.464 ' O ' ' HG ' ' A' 3639 ' ' LEU . 58.7 p -65.32 -52.55 53.22 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 120.682 -0.407 . . . . 0.0 110.105 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . 0.55 ' HG2' ' O ' ' A' 3632 ' ' CYS . 5.6 mm-40 -63.68 -35.53 80.86 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.402 -175.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 14.3 p -64.56 -54.69 28.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.606 -176.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -71.34 -19.47 62.29 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 118.871 -1.132 . . . . 0.0 110.733 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' 3635 ' ' SER . 41.9 mt -64.9 -35.84 82.44 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.903 -0.319 . . . . 0.0 110.23 172.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.534 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 18.1 m -70.31 -31.83 69.33 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.423 0.63 . . . . 0.0 109.941 178.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -76.06 -43.92 41.45 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.218 -0.901 . . . . 0.0 110.849 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.778 HD13 HD22 ' A' 3575 ' ' LEU . 17.9 mt -85.21 -38.96 18.34 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.512 -0.767 . . . . 0.0 112.753 -172.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -147.85 82.92 7.66 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 120.899 0.381 . . . . 0.0 111.556 -177.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.59 -28.06 21.74 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 123.069 2.513 . . . . 0.0 113.882 -174.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 4.2 t0 -77.73 -37.93 48.19 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.33 -172.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.753 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -80.03 -31.17 39.57 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 175.184 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.534 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.04 -43.69 70.39 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.452 177.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -62.05 -25.76 67.87 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.382 -178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.701 ' HB3' ' HA ' ' A' 3496 ' ' VAL . 73.3 m -78.92 -40.23 32.65 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.026 0.441 . . . . 0.0 110.598 176.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.861 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.8 pt -82.79 -18.32 10.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.818 -172.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.9 t -59.08 -25.69 63.99 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.613 176.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -88.84 -35.0 16.82 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.919 0.39 . . . . 0.0 110.617 174.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.861 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.4 OUTLIER -98.84 30.97 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-O 122.81 1.291 . . . . 0.0 109.083 -175.56 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.427 ' N ' ' HD2' ' A' 3655 ' ' PRO . 18.7 m -30.03 -42.88 0.2 Allowed Pre-proline 0 CA--C 1.542 0.657 0 CA-C-N 113.763 -1.562 . . . . 0.0 114.851 173.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.431 ' HG2' HD13 ' A' 3653 ' ' ILE . 15.9 Cg_endo -60.55 65.69 0.08 OUTLIER 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.849 1.699 . . . . 0.0 112.345 168.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . 0.473 ' HB2' HD23 ' A' 3579 ' ' LEU . 23.6 p80 -136.37 174.15 10.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.866 -177.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.525 HD22 HG22 ' A' 3628 ' ' ILE . 31.6 mt -119.93 149.12 42.63 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.765 0.317 . . . . 0.0 110.853 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 51.8 ttp -112.88 110.94 21.35 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 174.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.861 HD12 HD21 ' A' 3524 ' ' LEU . 71.0 mt -105.63 118.35 52.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-O 121.153 0.501 . . . . 0.0 111.42 -172.125 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.667 HG13 ' HD2' ' A' 3573 ' ' TYR . 77.2 t -103.18 116.76 47.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.805 -178.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.626 HG12 ' HG ' ' A' 3626 ' ' LEU . 59.1 mt -90.95 114.98 29.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -113.11 127.94 56.35 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.852 0.358 . . . . 0.0 111.443 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 8.5 m -70.1 137.94 51.58 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.831 172.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 12.3 m . . . . . 0 C--O 1.248 1.017 0 CA-C-O 118.533 -0.746 . . . . 0.0 110.518 179.154 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.491 ' CD1' ' HB2' ' A' 3553 ' ' MET . 38.1 m-85 . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.537 ' O ' ' HG2' ' A' 3551 ' ' GLN . 1.3 tp10 55.29 -160.81 0.17 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-O 121.139 0.495 . . . . 0.0 110.897 175.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 7.7 p -144.2 129.9 19.19 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 167.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.575 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER -82.6 -126.21 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.517 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . 0.425 ' CG ' ' H ' ' B' 2524 ' ' SEP . 9.0 t70 -161.3 -156.19 0.44 Allowed 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -175.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . 0.425 ' H ' ' CG ' ' B' 2523 ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 . . . . . 0 C--O 1.247 0.955 0 CA-C-O 118.651 -0.69 . . . . 0.0 110.03 177.3 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.574 ' HB ' ' OE1' ' A' 3500 ' ' GLN . 34.0 m . . . . . 0 N--CA 1.48 1.045 0 N-CA-C 110.175 -0.306 . . . . 0.0 110.175 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 33.8 t70 -80.59 147.65 30.65 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 116.737 -0.21 . . . . 0.0 110.689 -177.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . 0.452 ' HA ' ' CD2' ' A' 3501 ' ' LEU . 73.6 mtm -62.87 -30.72 71.73 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 111.733 0.272 . . . . 0.0 111.733 -178.242 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.529 ' HA ' HD12 ' A' 3502 ' ' LEU . 88.8 t -64.76 -22.32 31.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-O 121.604 0.716 . . . . 0.0 110.468 177.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . 0.574 ' OE1' ' HB ' ' A' 3496 ' ' VAL . 51.8 mt-30 -79.21 -52.07 8.65 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.508 174.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.526 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp -67.29 -35.28 79.14 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -173.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.709 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -73.12 -15.53 61.48 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 120.098 -0.641 . . . . 0.0 110.477 -174.202 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.59 ' N ' HD13 ' A' 3502 ' ' LEU . 55.5 tptt -68.13 -28.33 67.22 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 175.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.452 ' HB3' ' CE2' ' A' 3505 ' ' TYR . 4.3 mmmm -92.26 -42.96 9.55 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.776 175.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.729 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -153.5 108.6 2.57 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.812 179.985 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . 0.709 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 94.0 Cg_endo -87.49 173.55 5.38 Favored 'Trans proline' 0 CA--C 1.531 0.345 0 C-N-CA 124.127 3.218 . . . . 0.0 114.025 -175.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.429 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.3 mt -72.11 132.71 33.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.61 -179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.462 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.0 m -103.4 -31.15 2.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.596 -177.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.722 ' HE3' HD12 ' A' 3524 ' ' LEU . 47.3 t90 -147.56 153.64 39.7 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 -175.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . 0.476 ' HG3' ' HB3' ' A' 3523 ' ' GLN . 21.7 tt0 -151.25 120.01 6.57 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 178.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -176.13 -123.29 0.76 Allowed Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 111.368 -0.693 . . . . 0.0 111.368 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.676 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.5 mp -141.04 157.12 45.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.059 0.457 . . . . 0.0 111.059 179.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.444 ' HG ' HG21 ' A' 3522 ' ' VAL . 92.3 mt -108.91 151.29 26.48 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.244 -1.021 . . . . 0.0 108.244 168.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.739 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -147.65 126.92 13.02 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.74 0.305 . . . . 0.0 111.465 -179.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.748 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.28 141.84 41.95 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 172.914 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.809 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.6 OUTLIER 63.6 -92.12 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 -169.446 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 11.5 m120 -147.22 15.1 1.15 Allowed 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 172.562 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.487 ' O ' ' HA ' ' A' 3514 ' ' ALA . 4.9 m-20 -96.02 123.26 39.55 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.361 -176.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.494 HG22 ' HB2' ' A' 3514 ' ' ALA . 37.0 p -113.75 138.77 49.79 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.074 0.464 . . . . 0.0 111.63 -177.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.97 116.11 14.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.473 174.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.644 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.73 122.94 20.78 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.97 0.414 . . . . 0.0 110.333 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.444 HG21 ' HG ' ' A' 3513 ' ' LEU . 35.2 m -132.43 149.03 31.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.915 -175.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . 0.476 ' HB3' ' HG3' ' A' 3510 ' ' GLN . 11.2 pt20 -112.45 127.59 56.08 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 170.006 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.887 HD21 HD12 ' A' 3659 ' ' ILE . 1.2 mt -95.35 113.3 24.95 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.779 -0.646 . . . . 0.0 112.039 -174.601 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.429 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 80.2 m-70 -88.0 136.31 33.02 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.714 175.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.729 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.1 t80 -67.67 139.55 56.78 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.55 -0.908 . . . . 0.0 108.55 174.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.572 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.5 t -115.1 -58.11 3.6 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 121.387 0.613 . . . . 0.0 110.979 176.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.44 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 65.0 m -159.69 171.91 18.7 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.275 -171.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.36 -152.02 23.11 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.44 -0.886 . . . . 0.0 112.632 177.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.59 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.6 t-20 -100.24 112.89 25.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.843 0.354 . . . . 0.0 110.608 -178.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 26.1 p-10 -64.67 -32.08 73.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.495 -176.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 39.9 t -59.47 -32.37 48.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.42 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.46 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 20.3 mt -58.42 -45.81 87.69 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.775 176.12 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -66.6 -40.84 89.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.112 0.482 . . . . 0.0 110.076 -179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 14.7 t60 -57.57 -41.73 81.68 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.707 179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -89.19 -14.32 36.32 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 112.697 0.629 . . . . 0.0 112.697 -176.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.451 ' O ' HG21 ' A' 3614 ' ' VAL . 42.4 p -96.81 -39.25 9.52 Favored 'General case' 0 C--N 1.33 -0.266 0 O-C-N 121.981 -0.449 . . . . 0.0 111.617 -179.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.722 HD13 ' HB2' ' A' 3509 ' ' TRP . 31.1 mt -80.43 108.65 10.21 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-O 120.926 0.393 . . . . 0.0 109.978 -175.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -74.9 147.49 34.45 Favored 'Trans proline' 0 N--CA 1.459 -0.547 0 C-N-CA 122.854 2.369 . . . . 0.0 113.06 -171.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.496 HD23 ' CD1' ' A' 3509 ' ' TRP . 3.2 pp -175.51 154.78 1.69 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.307 -0.86 . . . . 0.0 111.251 178.131 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 13.3 m -135.64 -40.7 0.7 Allowed 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.826 -1.079 . . . . 0.0 108.206 170.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -146.6 98.23 3.03 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.438 173.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 93.35 -107.16 3.5 Favored Glycine 0 N--CA 1.442 -0.933 0 N-CA-C 111.153 -0.779 . . . . 0.0 111.153 -174.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 175.59 112.96 0.31 Allowed Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.261 -0.971 . . . . 0.0 113.059 179.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.39 150.79 70.89 Favored 'Trans proline' 0 C--N 1.343 0.284 0 C-N-CA 123.138 2.559 . . . . 0.0 111.729 176.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.676 ' HA ' ' O ' ' A' 3512 ' ' LEU . 34.8 Cg_endo -64.01 124.75 14.01 Favored 'Trans proline' 0 CA--C 1.529 0.266 0 C-N-CA 122.691 2.261 . . . . 0.0 113.439 -175.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.688 ' HB3' HD13 ' A' 3612 ' ' ILE . 29.1 mt -69.24 124.18 23.13 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.84 173.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.739 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -105.05 142.49 34.74 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.782 0.325 . . . . 0.0 111.773 -173.903 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.557 HG22 HD12 ' B' 2521 ' ' LEU . 34.9 mt -98.89 107.03 19.76 Favored 'Isoleucine or valine' 0 C--O 1.254 1.298 0 CA-C-O 122.608 1.194 . . . . 0.0 112.069 -172.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.435 ' HA ' ' HB2' ' B' 2523 ' ' ASP . . . -107.34 -9.04 16.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 114.614 -1.175 . . . . 0.0 111.949 -173.463 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.657 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 58.8 mt-30 -146.29 175.2 10.7 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.951 -0.113 . . . . 0.0 110.859 -178.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.686 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -156.32 137.0 13.29 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.87 0.367 . . . . 0.0 111.353 -179.558 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.64 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 13.6 tmm? -108.17 113.79 27.19 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.174 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' 3556 ' ' GLU . 14.1 mmt180 -62.52 110.34 1.66 Allowed 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 175.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.494 ' O ' HD12 ' A' 3555 ' ' LEU . 2.3 pp -68.29 97.96 0.78 Allowed 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.304 1.05 . . . . 0.0 109.809 -173.634 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.622 ' O ' ' HG ' ' A' 3560 ' ' LEU . 41.5 mt-10 -95.34 154.41 17.21 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 114.256 -1.338 . . . . 0.0 109.482 -178.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.612 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.49 -42.68 74.76 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.22 0.534 . . . . 0.0 109.725 174.047 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 19.3 m -63.26 -41.5 99.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.316 -0.856 . . . . 0.0 110.945 177.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.585 ' O ' HG23 ' A' 3563 ' ' VAL . 27.7 mm-40 -62.97 -48.34 79.29 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.435 177.262 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.622 ' HG ' ' O ' ' A' 3556 ' ' GLU . 69.5 mt -59.02 -35.87 74.0 Favored 'General case' 0 C--N 1.329 -0.298 0 O-C-N 123.288 0.367 . . . . 0.0 110.873 -178.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.9 mm-40 -57.97 -51.72 68.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.428 0.632 . . . . 0.0 110.497 174.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -63.95 -40.1 97.95 Favored Glycine 0 N--CA 1.452 -0.294 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.226 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.664 ' O ' ' HG3' ' A' 3567 ' ' MET . 73.2 t -59.62 -48.18 88.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 176.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -53.67 -42.7 68.18 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.196 179.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.569 ' O ' ' HB ' ' A' 3568 ' ' THR . 96.4 mtt180 -60.42 -44.46 95.74 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.851 -179.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 -76.55 -15.3 59.9 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 120.465 -0.494 . . . . 0.0 111.087 178.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.664 ' HG3' ' O ' ' A' 3563 ' ' VAL . 88.0 mtp -83.74 -19.19 35.59 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.687 0.756 . . . . 0.0 109.126 173.016 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . 0.569 ' HB ' ' O ' ' A' 3565 ' ' ARG . 56.2 m -77.06 -21.59 54.23 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 114.701 -1.136 . . . . 0.0 110.009 176.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 60.5 t -116.45 84.51 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.9 177.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -69.0 108.13 3.4 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 178.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.59 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 1.9 m 157.88 -42.99 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.249 1.42 . . . . 0.0 108.02 -173.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -84.8 -17.36 38.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.025 -177.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.724 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -138.17 163.9 30.54 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-O 120.979 0.419 . . . . 0.0 109.994 177.401 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.631 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 29.3 t -126.12 135.64 51.94 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 172.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.746 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.97 125.54 51.11 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 178.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.603 HD11 HD11 ' A' 3661 ' ' ILE . 82.2 mt -126.72 154.89 43.55 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.11 0.481 . . . . 0.0 110.837 -177.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.608 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -120.83 108.02 13.43 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.611 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.488 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.68 122.42 37.27 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.299 0.571 . . . . 0.0 110.495 -177.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.457 ' HG ' HD12 ' A' 3577 ' ' LEU . 83.4 mt -126.75 142.01 42.08 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 114.877 -1.056 . . . . 0.0 110.688 -178.415 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . 0.495 ' HA ' ' O ' ' A' 3521 ' ' ALA . 20.5 Cg_endo -60.46 117.3 4.05 Favored 'Trans proline' 0 CA--C 1.531 0.355 0 C-N-CA 122.67 2.247 . . . . 0.0 112.091 179.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.4 p -101.58 107.8 19.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.272 0.558 . . . . 0.0 111.003 -177.074 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.71 146.18 16.34 Favored Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.604 -179.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 5.2 ttp85 -64.72 -35.29 80.57 Favored 'General case' 0 N--CA 1.443 -0.793 0 CA-C-O 121.596 0.712 . . . . 0.0 110.064 176.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.598 ' O ' HG23 ' A' 3588 ' ' VAL . 15.1 t70 -134.92 164.37 27.75 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -55.42 -38.38 68.9 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 117.994 0.361 . . . . 0.0 110.392 178.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -62.2 -44.64 96.12 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.507 176.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.456 ' HB3' ' H ' ' A' 3584 ' ' ASP . 24.4 t0 -63.71 -40.87 97.84 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.013 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' 3584 ' ' ASP . 91.4 t -57.04 -48.55 81.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.043 176.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 65.5 t -57.36 -48.73 82.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.348 176.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 48.0 t -54.86 -53.34 56.68 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.097 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -66.25 -36.11 82.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.387 -177.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 78.7 m -60.73 -50.94 71.47 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 176.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.524 ' HA ' ' HD3' ' A' 3596 ' ' LYS . 39.5 tp10 -61.3 -44.45 97.19 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.005 -178.607 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 37.5 m -61.36 -45.34 94.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.69 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.559 HD12 ' HB2' ' A' 3599 ' ' PHE . 59.5 tp -60.85 -42.77 98.48 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.429 178.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.568 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 50.2 mtpt -55.78 -54.16 47.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.853 177.316 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.79 -40.67 88.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.274 -176.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -89.93 -46.86 8.24 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -169.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.559 ' HB2' HD12 ' A' 3595 ' ' LEU . 22.3 m-85 -99.56 -50.43 4.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 120.753 0.311 . . . . 0.0 111.515 -175.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.568 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.0 mm -61.32 -54.39 35.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.717 -176.116 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 45.8 m -59.89 -41.12 90.89 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.267 -179.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.702 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -65.98 -57.03 8.72 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.906 179.06 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.702 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.3 OUTLIER -56.8 -43.61 81.12 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -177.578 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 3.1 pt20 -69.63 -35.83 75.59 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.491 -176.739 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -67.86 -38.89 83.68 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.105 0.478 . . . . 0.0 110.659 -179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -78.81 -18.04 54.73 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.627 179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 49.67 53.7 12.28 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 -169.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.521 ' O ' HD12 ' A' 3603 ' ' LEU . . . -133.94 -175.89 3.99 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.618 -0.719 . . . . 0.0 112.044 -170.105 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.686 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.38 118.32 30.04 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.411 175.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . 0.493 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.77 104.03 0.79 Allowed Glycine 0 C--O 1.221 -0.707 0 C-N-CA 120.718 -0.753 . . . . 0.0 111.292 177.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.657 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 38.9 mm -90.12 122.45 41.49 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 CA-C-O 121.333 0.587 . . . . 0.0 111.439 -173.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.688 HD13 ' HB3' ' A' 3547 ' ' LEU . 51.1 mt -119.71 111.56 33.35 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.221 176.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.517 ' HA ' ' O ' ' A' 3624 ' ' TYR . 0.8 OUTLIER -87.46 125.59 34.39 Favored 'General case' 0 CA--C 1.512 -0.499 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 176.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.451 HG21 ' O ' ' A' 3537 ' ' SER . 5.3 p -130.38 128.72 22.7 Favored Pre-proline 0 C--N 1.315 -0.919 0 CA-C-O 121.02 0.438 . . . . 0.0 111.262 -178.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.598 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 61.7 Cg_endo -75.55 142.4 26.19 Favored 'Trans proline' 0 N--CA 1.458 -0.606 0 C-N-CA 122.576 2.184 . . . . 0.0 112.102 175.569 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.46 ' OD1' ' HB2' ' A' 3619 ' ' SER . 2.6 t-20 -103.11 100.89 18.75 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 175.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -35.71 93.22 0.02 OUTLIER 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 125.074 3.849 . . . . 0.0 115.316 -168.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 58.5 12.38 13.1 Favored Glycine 0 C--N 1.334 0.432 0 CA-C-N 115.523 -0.762 . . . . 0.0 113.651 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . 0.46 ' HB2' ' OD1' ' A' 3616 ' ' ASN . 15.0 m -106.28 -19.31 13.74 Favored 'General case' 0 C--N 1.322 -0.624 0 O-C-N 122.741 -0.27 . . . . 0.0 111.307 -174.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 8.6 t30 -157.72 -75.96 0.09 Allowed 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.456 178.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.588 ' HG2' ' HD2' ' A' 3622 ' ' PRO . 0.9 OUTLIER 170.61 168.29 0.2 Allowed Pre-proline 0 N--CA 1.468 0.471 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -172.983 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.598 ' HA ' ' HA ' ' A' 3615 ' ' PRO . 44.1 Cg_endo -75.06 21.73 0.43 Allowed 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.696 2.264 . . . . 0.0 111.44 165.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . 0.485 ' HB1' HG23 ' A' 3664 ' ' VAL . . . -84.36 41.38 0.83 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.961 -176.279 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.517 ' O ' ' HA ' ' A' 3613 ' ' ASN . 86.4 m-85 -120.51 131.83 54.9 Favored 'General case' 0 CA--C 1.506 -0.74 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.703 177.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.477 HG12 ' HG3' ' A' 3627 ' ' GLN . 4.1 t -122.23 113.16 37.56 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.987 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.902 179.059 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.66 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -94.46 111.34 23.09 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 108.485 -0.931 . . . . 0.0 108.485 170.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.487 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 63.0 mt-30 -94.4 110.66 22.42 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.76 -177.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.607 HG12 HG12 ' A' 3659 ' ' ILE . 32.8 mt -90.87 97.84 7.69 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.086 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -86.29 141.2 34.63 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.856 -0.611 . . . . 0.0 109.984 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.655 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 60.7 Cg_endo -72.92 169.69 21.52 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.486 2.124 . . . . 0.0 111.361 176.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -67.03 77.63 0.41 Allowed 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.441 2.094 . . . . 0.0 111.64 175.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . 0.537 ' O ' ' HG2' ' A' 3636 ' ' GLU . 10.4 p -112.88 162.64 15.59 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.044 -174.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -45.99 -39.75 9.45 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.469 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 46.6 t80 -61.52 -52.98 62.22 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.495 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 56.4 p -66.37 -54.77 20.62 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.927 -175.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . 0.537 ' HG2' ' O ' ' A' 3632 ' ' CYS . 5.3 mm-40 -59.39 -38.56 80.84 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.268 -173.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 39.0 t -66.33 -50.11 64.72 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 120.752 0.311 . . . . 0.0 110.667 -178.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 44.5 m-70 -65.81 -31.81 72.99 Favored 'General case' 0 CA--C 1.519 -0.214 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.42 -179.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 79.2 mt -64.92 -30.98 72.01 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.956 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.763 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 20.1 m -74.84 -31.46 61.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.323 0.582 . . . . 0.0 109.89 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 1.4 tpm_? -79.61 -47.2 15.86 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.932 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.746 HD13 HD22 ' A' 3575 ' ' LEU . 14.7 mt -79.36 -41.8 27.03 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.732 -0.667 . . . . 0.0 112.139 -173.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.462 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -138.2 72.08 46.28 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 112.124 0.416 . . . . 0.0 112.124 -174.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -64.71 -19.29 64.47 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.207 1.938 . . . . 0.0 112.014 179.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . 0.473 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 6.6 m-20 -67.84 -60.78 2.25 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.762 -0.653 . . . . 0.0 109.559 -178.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.608 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -77.15 -26.42 53.03 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.635 -178.27 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.763 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.18 -44.12 71.27 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.231 177.01 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.99 -18.07 63.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.47 -178.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 17.9 m -89.62 -36.76 15.1 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.052 0.453 . . . . 0.0 110.545 177.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.777 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.2 pt -83.11 -10.5 11.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.785 -174.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.4 p -60.06 -25.18 65.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.958 0.408 . . . . 0.0 110.402 176.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -83.93 -41.87 16.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.313 0.577 . . . . 0.0 110.011 173.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.777 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.3 OUTLIER -99.57 34.21 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-O 123.184 1.469 . . . . 0.0 109.094 -172.366 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.45 ' N ' ' HD2' ' A' 3655 ' ' PRO . 23.2 m -34.67 -43.99 0.59 Allowed Pre-proline 0 CA--C 1.541 0.623 0 CA-C-N 113.529 -1.669 . . . . 0.0 114.489 173.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' 3654 ' ' SER . 15.8 Cg_endo -60.19 86.05 0.07 OUTLIER 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.656 1.571 . . . . 0.0 111.821 170.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 3.8 p-80 -152.12 178.29 9.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.488 -176.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.501 ' HB3' HG23 ' A' 3628 ' ' ILE . 42.2 mt -126.9 133.62 50.63 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.474 -179.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 60.1 ttp -97.32 109.99 22.63 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 108.828 -0.804 . . . . 0.0 108.828 175.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.887 HD12 HD21 ' A' 3524 ' ' LEU . 92.3 mt -100.59 116.74 44.66 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.28 0.562 . . . . 0.0 111.459 -173.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.724 HG13 ' HD2' ' A' 3573 ' ' TYR . 93.2 t -102.84 113.0 38.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.253 -0.885 . . . . 0.0 110.97 -178.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.66 HG12 ' HG ' ' A' 3626 ' ' LEU . 53.6 mt -90.78 113.13 26.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.294 179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.62 127.98 55.91 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.687 0.279 . . . . 0.0 111.07 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 11.7 p -95.85 110.94 23.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.056 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . 0.485 HG23 ' HB1' ' A' 3623 ' ' ALA . 6.9 m . . . . . 0 C--O 1.248 0.98 0 CA-C-O 119.409 -0.329 . . . . 0.0 111.074 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.571 ' CD1' ' HB2' ' A' 3553 ' ' MET . 20.3 m-85 . . . . . 0 N--CA 1.482 1.144 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.577 ' CG ' ' H ' ' B' 2520 ' ' THR . 8.6 tt0 55.98 -158.24 0.23 Allowed 'General case' 0 CA--C 1.538 0.519 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 175.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.577 ' H ' ' CG ' ' B' 2519 ' ' GLU . 88.9 m -151.78 123.65 8.03 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 174.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.624 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.1 OUTLIER -79.71 -119.1 0.02 OUTLIER 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -178.328 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.809 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . 0.435 ' HB2' ' HA ' ' A' 3550 ' ' ALA . 21.7 t70 -110.21 174.33 5.91 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 114.331 -1.304 . . . . 0.0 112.744 -158.622 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.485 -0.769 . . . . 0.0 109.919 174.241 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.59 ' CG2' ' HA ' ' A' 3649 ' ' SER . 3.1 m . . . . . 0 N--CA 1.48 1.051 0 CA-C-O 121.451 0.643 . . . . 0.0 110.811 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -90.89 153.87 19.89 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.587 -0.733 . . . . 0.0 112.036 -174.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . 0.415 ' O ' HD12 ' A' 3502 ' ' LEU . 56.5 mtp -63.58 -23.3 67.33 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.493 176.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.455 ' HA ' HD12 ' A' 3502 ' ' LEU . 45.6 t -62.3 -24.58 35.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.465 -0.788 . . . . 0.0 111.356 -178.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -82.29 -52.78 6.6 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.974 0.416 . . . . 0.0 110.362 176.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.613 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.7 pp -66.25 -37.08 84.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.139 -173.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.64 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -71.31 -15.76 62.42 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.192 -173.31 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.64 ' N ' HD13 ' A' 3502 ' ' LEU . 23.5 tptm -69.59 -27.06 64.78 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.273 177.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.713 ' HD3' ' CE2' ' A' 3505 ' ' TYR . 32.5 tttt -100.37 -42.02 6.8 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.475 179.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.713 ' CE2' ' HD3' ' A' 3504 ' ' LYS . 0.1 OUTLIER -146.71 106.9 4.02 Favored Pre-proline 0 CA--C 1.537 0.458 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.308 177.038 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -86.52 174.01 6.09 Favored 'Trans proline' 0 CA--C 1.536 0.577 0 C-N-CA 124.27 3.313 . . . . 0.0 113.886 -179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.559 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 95.2 mt -72.05 138.79 20.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.118 -179.454 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.439 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.7 m -105.94 -28.17 2.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.785 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.649 ' HB2' HD13 ' A' 3538 ' ' LEU . 21.1 t90 -153.54 154.75 34.89 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 -176.549 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -151.14 121.4 7.27 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.117 0.484 . . . . 0.0 110.126 178.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -171.75 -123.94 0.73 Allowed Glycine 0 N--CA 1.441 -0.997 0 N-CA-C 111.082 -0.807 . . . . 0.0 111.082 -178.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.662 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.1 mp -141.34 158.76 43.45 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.1 0.476 . . . . 0.0 111.094 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.452 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.5 mt -112.79 151.46 30.32 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 168.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.668 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.75 125.93 14.66 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.729 0.3 . . . . 0.0 111.575 -178.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.788 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.02 142.59 38.25 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 173.119 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.829 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.5 OUTLIER 59.88 -94.93 0.05 Allowed 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.119 0.485 . . . . 0.0 110.157 -171.268 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -136.47 4.78 2.9 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.264 -0.88 . . . . 0.0 109.192 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.429 ' O ' ' HA ' ' A' 3514 ' ' ALA . 47.8 m-20 -102.53 138.54 39.31 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.333 -172.79 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.537 HG22 ' HB2' ' A' 3514 ' ' ALA . 27.8 p -127.02 138.04 53.18 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.943 -179.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -133.83 119.97 19.86 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.08 176.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.662 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -71.92 120.19 17.17 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.049 0.452 . . . . 0.0 110.52 178.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.433 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 33.7 m -132.06 147.76 32.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 115.734 -0.666 . . . . 0.0 111.857 -175.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -110.95 129.9 55.75 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.047 -0.979 . . . . 0.0 108.838 172.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.886 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -98.09 110.67 23.21 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.356 0.598 . . . . 0.0 111.886 -175.51 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.559 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 54.8 m-70 -84.99 137.11 33.28 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 114.938 -1.028 . . . . 0.0 108.56 175.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.707 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.7 t80 -67.08 136.38 55.1 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 173.772 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.563 ' CG1' HD23 ' A' 3575 ' ' LEU . 18.8 t -115.11 -55.89 4.22 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.774 0 CA-C-O 121.42 0.629 . . . . 0.0 110.798 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.415 ' OG ' HD22 ' A' 3642 ' ' LEU . 48.0 t -159.04 171.72 19.49 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.708 -172.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.42 -150.22 21.14 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.766 175.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.557 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.7 t-20 -104.87 110.33 22.65 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -61.64 -29.6 70.17 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.544 -176.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . 0.538 ' HB ' ' OD1' ' A' 3530 ' ' ASN . 60.9 t -60.55 -33.46 54.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.364 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.552 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 20.4 mt -57.37 -41.46 80.21 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.944 176.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.519 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.76 -45.62 77.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.847 0.356 . . . . 0.0 110.462 179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -60.99 -33.88 73.93 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.187 -178.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.403 ' HD3' HD23 ' A' 3533 ' ' LEU . 15.5 ptm180 -90.01 -13.91 35.04 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 -178.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.458 ' HB2' HD11 ' A' 3626 ' ' LEU . 66.5 p -101.87 -34.72 9.28 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 122.014 -0.429 . . . . 0.0 111.317 -177.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.649 HD13 ' HB2' ' A' 3509 ' ' TRP . 26.9 mt -80.44 114.08 44.57 Favored Pre-proline 0 C--N 1.319 -0.72 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -177.175 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -78.4 152.66 26.88 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 123.073 2.515 . . . . 0.0 113.431 -169.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 1.3 pt? -154.85 130.9 10.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.567 177.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 42.5 t -148.19 6.53 0.77 Allowed 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.207 0.527 . . . . 0.0 110.675 -176.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . 0.787 ' HG3' ' H ' ' A' 3543 ' ' GLY . 4.3 pt-20 -163.57 -77.28 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.261 -173.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . 0.787 ' H ' ' HG3' ' A' 3542 ' ' GLU . . . -131.43 -61.56 0.09 OUTLIER Glycine 0 C--N 1.312 -0.797 0 CA-C-N 115.18 -0.918 . . . . 0.0 110.863 173.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -168.22 85.97 0.09 OUTLIER Glycine 0 N--CA 1.449 -0.46 0 N-CA-C 111.491 -0.644 . . . . 0.0 111.491 176.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -63.56 132.81 36.96 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.885 2.39 . . . . 0.0 112.449 -177.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.603 ' HA ' ' O ' ' A' 3512 ' ' LEU . 37.1 Cg_endo -67.03 126.51 15.3 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.75 2.3 . . . . 0.0 112.801 -177.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.729 ' HB3' HD13 ' A' 3612 ' ' ILE . 37.9 mt -68.82 118.09 11.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.4 178.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.668 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.1 OUTLIER -94.24 133.75 37.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.199 0.523 . . . . 0.0 111.439 -178.116 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.63 HG22 HD12 ' B' 2521 ' ' LEU . 23.1 mt -84.49 108.05 16.25 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-O 122.185 0.993 . . . . 0.0 110.75 -177.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . . . . . . . . . . . -105.01 -12.31 16.23 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.594 -1.184 . . . . 0.0 111.733 -171.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.652 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 87.5 mt-30 -150.36 177.55 9.87 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.54 -177.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.724 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.32 141.7 19.64 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-O 120.693 0.282 . . . . 0.0 111.411 179.495 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.629 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 13.5 tmm? -109.75 109.03 19.6 Favored 'General case' 0 CA--C 1.507 -0.695 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 175.144 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . 0.445 ' O ' ' HG3' ' A' 3556 ' ' GLU . 49.1 mtt180 -58.97 110.97 1.14 Allowed 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' 3555 ' ' LEU . 2.3 pp -68.39 99.18 0.91 Allowed 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 122.304 1.049 . . . . 0.0 110.56 -173.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.523 ' O ' ' HG ' ' A' 3560 ' ' LEU . 33.9 mt-10 -103.04 157.76 16.77 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.371 -1.286 . . . . 0.0 109.081 176.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.508 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.91 -50.53 70.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.622 0.249 . . . . 0.0 110.908 -179.119 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 25.6 p -62.19 -39.66 93.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.988 0.423 . . . . 0.0 111.255 178.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.519 ' O ' HG23 ' A' 3563 ' ' VAL . 57.5 mm-40 -65.97 -41.13 91.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.563 -178.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.54 HD21 ' HB2' ' A' 3555 ' ' LEU . 83.7 mt -64.24 -34.78 78.9 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.779 0.323 . . . . 0.0 110.809 -179.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' 3557 ' ' ALA . 12.1 mm-40 -68.66 -41.66 79.0 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 174.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -57.8 -41.51 94.04 Favored Glycine 0 CA--C 1.517 0.164 0 CA-C-N 115.285 -0.87 . . . . 0.0 111.796 175.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.561 ' O ' ' HG3' ' A' 3567 ' ' MET . 95.5 t -61.7 -51.38 73.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 174.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . 0.515 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.63 -24.05 63.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.903 -178.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -61.15 -40.02 92.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.88 0.371 . . . . 0.0 110.536 -179.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . 0.41 HH11 ' HD3' ' A' 3566 ' ' ARG . 9.9 ptp180 -87.99 -14.69 38.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.998 0.427 . . . . 0.0 110.569 176.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.561 ' HG3' ' O ' ' A' 3563 ' ' VAL . 84.9 mtp -74.68 -19.9 60.08 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.188 -178.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 14.7 t -89.01 3.29 52.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.112 0.482 . . . . 0.0 110.078 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 28.1 t -125.99 91.27 1.75 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.52 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -67.56 110.23 3.58 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.349 179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.557 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.3 m 144.19 -38.98 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.561 1.544 . . . . 0.0 108.583 -177.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -82.19 -20.65 37.39 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.782 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.747 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -144.38 165.55 27.59 Favored 'General case' 0 N--CA 1.45 -0.465 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.195 176.876 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.608 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 37.2 t -127.8 135.99 50.85 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 170.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.792 HD22 HD13 ' A' 3642 ' ' LEU . 14.7 tp -106.46 125.45 51.01 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.59 HD11 HD11 ' A' 3661 ' ' ILE . 78.7 mt -126.57 153.44 45.23 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.203 0.525 . . . . 0.0 110.558 -178.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.621 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -120.0 108.12 13.92 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.974 -0.751 . . . . 0.0 108.974 -179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.485 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.4 121.18 35.67 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.363 0.601 . . . . 0.0 110.449 -177.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.43 ' HG ' HD12 ' A' 3577 ' ' LEU . 68.2 mt -121.04 144.11 38.55 Favored Pre-proline 0 C--N 1.319 -0.732 0 CA-C-N 114.744 -1.117 . . . . 0.0 110.142 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.09 109.9 0.91 Allowed 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.215 1.944 . . . . 0.0 111.705 177.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 18.2 p -95.96 115.72 27.86 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.208 0.528 . . . . 0.0 110.2 -179.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . 0.442 ' HA3' HG22 ' A' 3588 ' ' VAL . . . -102.38 145.87 16.66 Favored Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 120.432 -0.889 . . . . 0.0 112.963 -176.041 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -19.35 63.64 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.827 0.822 . . . . 0.0 109.689 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.66 ' O ' HG23 ' A' 3588 ' ' VAL . 31.7 t70 -156.97 164.41 38.05 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 179.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 41.3 mt-30 -57.17 -35.57 69.71 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.021 0.439 . . . . 0.0 110.351 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.53 -41.52 79.8 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.778 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.541 ' HB3' ' H ' ' A' 3584 ' ' ASP . 13.9 t70 -61.94 -40.53 95.87 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.362 177.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.66 HG23 ' O ' ' A' 3584 ' ' ASP . 58.6 t -57.18 -45.04 84.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.271 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.325 178.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 7.1 t -62.31 -53.66 44.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-O 121.472 0.653 . . . . 0.0 109.616 -178.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 53.6 m -54.55 -48.88 71.49 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 114.472 -1.24 . . . . 0.0 111.601 178.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -68.89 -34.28 75.15 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -179.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 87.0 m -61.06 -46.77 89.34 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 120.851 -0.339 . . . . 0.0 110.115 177.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 69.3 mm-40 -64.84 -45.08 87.6 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 116.495 -0.32 . . . . 0.0 110.979 179.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 70.4 m -53.52 -43.45 68.32 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.736 174.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.538 HD12 ' HB2' ' A' 3599 ' ' PHE . 53.4 tp -67.86 -44.09 77.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.719 177.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.593 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 49.6 mtpt -57.98 -57.99 10.37 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.894 178.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -63.01 -34.68 78.09 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.819 -0.628 . . . . 0.0 112.606 -177.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.84 -47.43 6.15 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -171.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.538 ' HB2' HD12 ' A' 3595 ' ' LEU . 17.2 m-85 -99.62 -50.75 3.96 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.736 0.303 . . . . 0.0 111.529 -174.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 27.4 mm -61.5 -50.88 78.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.424 -176.464 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 60.4 m -58.73 -50.01 75.49 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.518 178.219 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.675 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.2 OUTLIER -59.75 -58.67 7.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.561 -178.913 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.675 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.4 OUTLIER -54.59 -41.35 69.79 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 112.082 0.401 . . . . 0.0 112.082 -176.679 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -79.28 -37.37 37.97 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.59 -0.444 . . . . 0.0 110.707 -176.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.29 -39.73 81.99 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 121.007 0.432 . . . . 0.0 111.185 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . 0.448 ' HG3' ' CD1' ' A' 3602 ' ' TYR . 21.6 mmmt -81.51 -15.79 53.83 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.928 178.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 52.79 65.42 1.52 Allowed 'General case' 0 C--O 1.232 0.149 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.338 -173.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.623 ' O ' HD12 ' A' 3603 ' ' LEU . . . -146.15 -174.6 4.48 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.916 0.388 . . . . 0.0 111.801 -175.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.724 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -121.81 118.75 29.76 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.65 177.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . 0.533 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.98 103.15 0.66 Allowed Glycine 0 C--O 1.221 -0.661 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.833 -178.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.652 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 39.7 mm -89.38 120.9 38.85 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.824 0 CA-C-O 121.312 0.577 . . . . 0.0 111.092 -174.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.729 HD13 ' HB3' ' A' 3547 ' ' LEU . 32.8 mt -120.52 107.43 20.69 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.862 176.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.449 ' HA ' ' O ' ' A' 3624 ' ' TYR . 48.9 m-80 -82.54 127.0 32.91 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.89 -0.595 . . . . 0.0 109.868 -179.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.463 ' O ' ' HA ' ' A' 3622 ' ' PRO . 35.0 m -122.68 147.45 50.66 Favored Pre-proline 0 C--N 1.321 -0.668 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.618 179.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.431 ' HA ' ' O ' ' A' 3621 ' ' GLN . 72.0 Cg_endo -92.15 135.81 1.55 Allowed 'Trans proline' 0 N--CA 1.444 -1.419 0 C-N-CA 122.517 2.144 . . . . 0.0 111.957 171.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.501 ' HB2' ' CE2' ' A' 3624 ' ' TYR . 9.5 t30 -69.36 113.05 14.03 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.17 -178.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo -51.83 114.61 1.68 Allowed 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 123.661 2.907 . . . . 0.0 112.945 -176.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 108.66 -31.07 8.1 Favored Glycine 0 N--CA 1.448 -0.523 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.382 -179.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 3.4 m -103.05 -22.88 13.72 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.741 0.305 . . . . 0.0 110.524 -178.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 66.9 t30 63.32 18.41 10.98 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.962 179.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.431 ' O ' ' HA ' ' A' 3615 ' ' PRO . 30.0 tt0 -90.67 112.15 51.65 Favored Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.532 -177.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.463 ' HA ' ' O ' ' A' 3614 ' ' VAL . 89.9 Cg_endo -85.57 23.5 0.83 Allowed 'Trans proline' 0 CA--C 1.529 0.268 0 C-N-CA 123.158 2.572 . . . . 0.0 112.973 -177.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -82.3 48.15 1.24 Allowed 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.048 0.452 . . . . 0.0 111.094 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.501 ' CE2' ' HB2' ' A' 3616 ' ' ASN . 72.0 m-85 -132.57 133.13 43.32 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.419 178.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.421 HG13 HD12 ' A' 3611 ' ' ILE . 4.5 t -120.5 116.01 48.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.303 -0.862 . . . . 0.0 110.234 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -97.57 111.71 23.87 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 169.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.426 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 39.1 mt-30 -94.76 111.29 23.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.067 -177.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.603 HG12 HG12 ' A' 3659 ' ' ILE . 45.2 mt -89.61 98.91 8.63 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.294 178.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -88.34 139.5 30.18 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 115.954 -0.567 . . . . 0.0 109.996 178.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.547 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 47.5 Cg_endo -68.56 172.95 10.59 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 122.73 2.287 . . . . 0.0 111.765 178.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -71.03 37.45 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.778 2.318 . . . . 0.0 112.359 176.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . 0.431 ' H ' ' C ' ' A' 3630 ' ' PRO . 24.4 p -77.71 163.47 26.14 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.908 -178.873 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -44.67 -40.94 6.31 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.288 179.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . 0.443 ' HB2' HD13 ' A' 3560 ' ' LEU . 51.2 t80 -52.67 -51.53 59.83 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 34.4 p -70.08 -54.22 14.03 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.823 -0.351 . . . . 0.0 111.126 -173.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -58.81 -37.66 76.87 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 -176.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 15.0 t -62.82 -50.71 69.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.094 0.473 . . . . 0.0 110.341 179.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 41.3 m-70 -67.71 -32.72 73.56 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.647 179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . 0.435 ' HB3' HD23 ' A' 3647 ' ' LEU . 79.1 mt -63.94 -39.51 94.32 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.726 176.327 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . . . . . . . . . 46.6 m -67.21 -26.76 66.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.265 0.555 . . . . 0.0 110.298 178.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 24.9 ttm180 -80.42 -47.52 14.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.759 178.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.792 HD13 HD22 ' A' 3575 ' ' LEU . 9.9 mt -86.9 -31.82 20.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.908 -170.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.419 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -150.45 73.24 9.07 Favored Pre-proline 0 C--N 1.328 -0.365 0 N-CA-C 112.055 0.391 . . . . 0.0 112.055 -174.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -67.24 -16.4 48.37 Favored 'Trans proline' 0 C--O 1.232 0.207 0 C-N-CA 122.723 2.282 . . . . 0.0 111.958 179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . 0.598 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 3.9 m-20 -71.92 -55.03 8.22 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.083 -178.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.621 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.5 -30.19 47.03 Favored 'General case' 0 N--CA 1.444 -0.754 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.889 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.502 ' HA ' ' CG1' ' A' 3650 ' ' ILE . 3.3 tm? -54.5 -43.2 71.61 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.909 0.385 . . . . 0.0 110.235 177.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . 0.441 ' O ' HG21 ' A' 3496 ' ' VAL . . . -63.25 -21.69 66.39 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.511 -178.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.59 ' HA ' ' CG2' ' A' 3496 ' ' VAL . 14.7 t -90.1 -31.12 17.25 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.89 0.376 . . . . 0.0 110.728 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.615 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.0 pt -84.72 -11.4 11.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.768 -175.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 10.7 p -62.78 -20.5 65.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.025 0.441 . . . . 0.0 110.521 175.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -85.51 -38.05 18.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.254 0.549 . . . . 0.0 109.94 173.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.615 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.1 tp -105.22 41.17 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 122.322 1.058 . . . . 0.0 109.446 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.466 ' N ' ' HD2' ' A' 3655 ' ' PRO . 64.5 m -36.71 -44.51 1.17 Allowed Pre-proline 0 CA--C 1.539 0.526 0 CA-C-N 114.26 -1.336 . . . . 0.0 113.837 172.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' 3654 ' ' SER . 12.8 Cg_endo -58.73 88.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.491 1.46 . . . . 0.0 111.744 169.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.5 p-80 -157.16 177.67 11.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.343 -177.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.44 HD11 HD11 ' A' 3595 ' ' LEU . 36.3 mt -127.96 139.67 52.44 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.81 -178.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 55.6 ttp -102.48 109.27 20.85 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.886 HD12 HD21 ' A' 3524 ' ' LEU . 79.4 mt -101.21 116.29 44.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 CA-C-O 121.291 0.567 . . . . 0.0 111.25 -173.163 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.747 HG13 ' HD2' ' A' 3573 ' ' TYR . 71.7 t -101.6 115.71 43.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.928 -177.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.625 HG12 ' HG ' ' A' 3626 ' ' LEU . 64.9 mt -90.84 112.7 25.49 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -114.31 127.7 55.99 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.898 0.38 . . . . 0.0 111.599 -177.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 53.0 m -84.42 135.12 34.4 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.008 171.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 5.9 p . . . . . 0 C--O 1.249 1.071 0 CA-C-O 119.008 -0.52 . . . . 0.0 109.67 176.155 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.629 ' CD1' ' HB2' ' A' 3553 ' ' MET . 38.3 m-85 . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 111.501 0.186 . . . . 0.0 111.501 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.577 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 4.9 mm-40 52.38 -152.14 0.26 Allowed 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 121.551 0.691 . . . . 0.0 110.788 177.846 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 76.3 m -153.27 117.19 4.78 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 169.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.655 HD23 ' NH1' ' A' 3552 ' ' ARG . 0.1 OUTLIER -78.95 -129.48 0.02 OUTLIER 'General case' 0 CA--C 1.518 -0.264 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.746 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.829 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -128.89 -161.39 1.11 Allowed 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.753 -170.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 43.0 mm-40 . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.271 -0.871 . . . . 0.0 111.416 -178.218 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.459 ' HB ' ' HB3' ' A' 3649 ' ' SER . 35.9 m . . . . . 0 N--CA 1.479 0.985 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 11.9 t70 -105.47 111.08 23.65 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 -179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . 0.568 ' HG2' ' HB3' ' A' 3502 ' ' LEU . 55.5 ttp -82.41 -25.06 34.03 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.377 178.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.48 ' HA ' HD12 ' A' 3502 ' ' LEU . 22.3 t -61.11 -24.93 34.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.025 -173.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -80.15 -60.63 2.26 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 120.745 0.307 . . . . 0.0 110.526 173.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.563 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.1 pp -61.69 -38.63 88.54 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -174.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.643 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -69.09 -15.99 63.57 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 118.502 0.592 . . . . 0.0 110.872 -172.26 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.646 ' HA ' ' HE2' ' A' 3503 ' ' LYS . 7.7 mmpt? -78.51 -15.61 58.4 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.969 0.414 . . . . 0.0 109.921 177.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -101.02 -43.69 5.96 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 174.032 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.707 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.7 103.65 3.05 Favored Pre-proline 0 N--CA 1.443 -0.789 0 CA-C-N 115.048 -0.978 . . . . 0.0 110.715 179.786 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -84.0 174.97 7.96 Favored 'Trans proline' 0 CA--C 1.531 0.373 0 C-N-CA 124.381 3.387 . . . . 0.0 113.705 -176.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.439 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 93.0 mt -70.63 139.41 20.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.044 179.241 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 27.4 m -107.17 -26.27 3.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.357 179.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.844 ' HD1' HD23 ' A' 3540 ' ' LEU . 61.2 t90 -153.87 145.41 23.21 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 18.8 tt0 -142.42 120.02 11.78 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 177.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.98 -128.19 1.01 Allowed Glycine 0 N--CA 1.442 -0.942 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 -178.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.624 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.0 mp -139.45 151.84 46.55 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.051 0.453 . . . . 0.0 110.901 179.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.47 HD23 ' HB2' ' A' 3547 ' ' LEU . 78.6 mt -105.74 146.03 30.35 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 107.592 -1.262 . . . . 0.0 107.592 168.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.661 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -141.47 123.39 15.37 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.746 -0.381 . . . . 0.0 111.755 -176.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.723 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.15 146.49 40.69 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 173.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.723 ' CD ' HD12 ' A' 3515 ' ' LEU . 1.1 mptm? 59.17 -92.91 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.179 0.592 . . . . 0.0 110.549 -171.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 10.0 m120 -142.08 4.98 1.68 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.187 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -103.02 135.73 44.17 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 120.552 -0.459 . . . . 0.0 111.384 -176.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.523 HG22 ' HB2' ' A' 3514 ' ' ALA . 7.2 p -116.31 132.25 56.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.867 177.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -124.27 112.86 17.51 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.143 -0.48 . . . . 0.0 109.71 176.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.624 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.78 121.32 17.8 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.434 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 26.8 m -132.64 147.79 31.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 CA-C-O 121.733 0.777 . . . . 0.0 111.911 -175.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -108.31 124.92 51.07 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 114.625 -1.17 . . . . 0.0 108.787 173.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.851 HD21 HD12 ' A' 3659 ' ' ILE . 1.4 mt -94.38 108.77 20.67 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.718 -175.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.485 ' HE1' ' SD ' ' A' 3498 ' ' MET . 83.7 m-70 -85.66 136.93 33.17 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.005 -0.998 . . . . 0.0 108.826 177.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.707 ' O ' ' HB2' ' A' 3505 ' ' TYR . 68.0 t80 -67.23 137.77 56.43 Favored 'General case' 0 C--N 1.315 -0.893 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 175.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.585 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.5 t -114.94 -56.43 4.1 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.53 0.681 . . . . 0.0 110.565 175.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 57.7 m -163.57 173.06 13.49 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.181 -0.918 . . . . 0.0 109.549 -171.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . 0.442 ' HA3' ' HA ' ' A' 3574 ' ' CYS . . . 90.78 -165.0 30.5 Favored Glycine 0 C--O 1.229 -0.2 0 C-N-CA 120.425 -0.893 . . . . 0.0 112.253 177.452 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.569 ' HB2' ' HA ' ' A' 3571 ' ' THR . 49.2 t30 -92.72 108.48 20.02 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.618 0.247 . . . . 0.0 110.539 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 7.8 p30 -61.12 -25.02 66.69 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.405 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 59.2 t -62.5 -32.87 56.69 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-O 120.947 0.403 . . . . 0.0 110.422 178.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.459 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 24.9 mt -60.52 -39.39 87.62 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.603 177.142 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.475 ' HB1' HD12 ' A' 3538 ' ' LEU . . . -67.69 -40.95 84.32 Favored 'General case' 0 C--O 1.223 -0.333 0 CA-C-O 120.72 0.295 . . . . 0.0 110.611 -178.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -59.59 -41.63 90.72 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.856 178.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -89.32 -7.74 54.73 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -174.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.566 ' HB2' HD11 ' A' 3626 ' ' LEU . 66.7 p -104.36 -41.6 5.72 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.086 0.47 . . . . 0.0 110.876 178.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.71 HD13 ' HB2' ' A' 3509 ' ' TRP . 25.7 mt -80.31 113.64 40.65 Favored Pre-proline 0 C--N 1.323 -0.577 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.627 -178.045 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -78.29 134.97 13.14 Favored 'Trans proline' 0 N--CA 1.452 -0.931 0 C-N-CA 122.39 2.06 . . . . 0.0 112.415 -176.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.844 HD23 ' HD1' ' A' 3509 ' ' TRP . 2.7 pp -161.59 -177.41 5.9 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.007 -0.997 . . . . 0.0 110.712 -175.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 70.9 m 72.81 -32.85 0.25 Allowed 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 123.472 0.709 . . . . 0.0 111.803 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . 0.404 ' H ' ' C ' ' A' 3540 ' ' LEU . 7.4 pt-20 -109.19 95.03 5.36 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.191 0.52 . . . . 0.0 110.705 177.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 77.07 -45.6 2.29 Favored Glycine 0 CA--C 1.518 0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 112.978 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 86.46 66.15 1.39 Allowed Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 110.858 -0.897 . . . . 0.0 110.858 -175.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.03 141.65 21.22 Favored 'Trans proline' 0 N--CA 1.461 -0.427 0 C-N-CA 122.714 2.276 . . . . 0.0 113.152 -173.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -72.14 134.6 23.45 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 122.569 2.179 . . . . 0.0 111.613 176.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.688 ' HB3' HD13 ' A' 3612 ' ' ILE . 36.0 mt -68.95 112.11 5.4 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 178.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.661 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -95.5 138.61 32.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.033 0.444 . . . . 0.0 110.792 -177.101 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.491 ' HA ' HG12 ' A' 3612 ' ' ILE . 17.9 mt -90.54 107.7 18.77 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 CA-C-O 122.155 0.979 . . . . 0.0 111.145 -174.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.422 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -106.99 -5.78 17.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 114.722 -1.126 . . . . 0.0 111.913 -172.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.664 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 85.0 mt-30 -150.92 175.65 11.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.654 0.264 . . . . 0.0 111.004 179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.751 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -149.92 138.9 21.06 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.049 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.76 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 22.0 ttt -109.77 107.73 17.83 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.276 175.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 34.6 mtm180 -60.09 110.73 1.28 Allowed 'General case' 0 C--N 1.316 -0.878 0 CA-C-O 120.804 0.335 . . . . 0.0 110.127 178.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.526 ' HB2' HD21 ' A' 3560 ' ' LEU . 1.8 pp -76.58 97.33 4.36 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 122.164 0.983 . . . . 0.0 109.863 -176.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.592 ' O ' ' HG ' ' A' 3560 ' ' LEU . 31.4 mt-10 -106.54 168.86 8.88 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.595 178.078 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.479 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -54.73 -50.57 68.03 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.724 0.297 . . . . 0.0 110.62 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 8.2 p -60.94 -40.89 94.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.389 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.583 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 77.8 mm-40 -66.31 -42.69 87.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.103 -177.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.592 ' HG ' ' O ' ' A' 3556 ' ' GLU . 84.3 mt -60.39 -35.31 75.44 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.751 -179.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' 3557 ' ' ALA . 15.0 mm-40 -59.89 -46.33 89.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.093 174.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -63.0 -38.76 97.14 Favored Glycine 0 N--CA 1.452 -0.247 0 CA-C-N 115.437 -0.802 . . . . 0.0 112.337 177.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.58 ' O ' ' HG3' ' A' 3567 ' ' MET . 62.1 t -62.02 -54.26 36.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.623 0.249 . . . . 0.0 110.429 177.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -60.87 -29.79 69.75 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.865 0.364 . . . . 0.0 111.11 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.429 ' O ' HG22 ' A' 3568 ' ' THR . 3.0 tmt_? -59.93 -42.5 94.13 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.58 179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 11.7 ptt180 -87.65 -10.34 51.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.197 179.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.58 ' HG3' ' O ' ' A' 3563 ' ' VAL . 85.9 mtp -85.24 -18.91 32.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.813 0.339 . . . . 0.0 111.413 -179.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . 0.429 HG22 ' O ' ' A' 3565 ' ' ARG . 12.0 t -82.96 -7.35 59.67 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.03 0.443 . . . . 0.0 110.529 -178.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 55.2 t -117.65 93.83 2.76 Favored 'Isoleucine or valine' 0 C--O 1.238 0.494 0 CA-C-O 121.043 0.449 . . . . 0.0 110.202 178.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -74.67 108.11 7.21 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.569 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.8 m 154.59 -41.66 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 125.482 1.513 . . . . 0.0 107.669 -172.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -87.01 -26.11 23.92 Favored 'General case' 0 C--O 1.241 0.607 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.179 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.853 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -132.62 163.56 28.63 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.931 177.472 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.618 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 42.1 t -128.29 136.63 51.26 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 170.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.804 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.2 126.11 51.73 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 -179.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.609 HD11 HD11 ' A' 3661 ' ' ILE . 79.4 mt -127.87 153.85 46.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.904 -177.588 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.757 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -119.56 108.23 14.25 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.415 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.515 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.18 120.71 34.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.39 0.614 . . . . 0.0 110.337 -178.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.564 ' HG ' HD12 ' A' 3577 ' ' LEU . 62.5 mt -123.09 145.32 45.69 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-N 114.659 -1.155 . . . . 0.0 109.855 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.62 126.73 22.16 Favored 'Trans proline' 0 CA--C 1.531 0.326 0 C-N-CA 122.377 2.051 . . . . 0.0 112.213 179.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 31.5 p -119.14 116.46 26.39 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.111 0.481 . . . . 0.0 109.871 177.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.32 146.05 16.39 Favored Glycine 0 N--CA 1.442 -0.928 0 C-N-CA 120.464 -0.874 . . . . 0.0 112.23 -178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . 0.421 ' HE ' ' CG ' ' A' 3587 ' ' ASP . 36.3 mtm180 -59.64 -46.79 87.94 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.444 0.64 . . . . 0.0 109.771 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.572 ' O ' HG23 ' A' 3588 ' ' VAL . 4.8 m-20 -132.12 177.06 7.85 Favored 'General case' 0 N--CA 1.439 -0.996 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.564 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -55.58 -43.0 75.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.931 0.396 . . . . 0.0 110.558 179.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -61.09 -46.5 90.37 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.246 178.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.534 ' O ' ' HG2' ' A' 3591 ' ' GLN . 15.0 t70 -63.47 -40.88 98.3 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.001 -178.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.572 HG23 ' O ' ' A' 3584 ' ' ASP . 72.1 t -53.85 -47.18 63.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.774 178.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 94.2 t -60.62 -46.5 95.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.304 177.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 46.8 t -62.61 -44.94 95.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.404 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' 3587 ' ' ASP . 72.1 mm-40 -64.35 -42.0 96.46 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.762 0.315 . . . . 0.0 110.287 -179.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . 0.424 ' O ' ' HG3' ' A' 3596 ' ' LYS . 57.8 m -59.63 -53.45 57.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.861 179.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' 3596 ' ' LYS . 11.2 pt-20 -65.5 -35.07 79.8 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 121.044 -0.263 . . . . 0.0 111.638 -177.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 38.1 m -65.43 -44.17 88.18 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.519 HD12 ' HB2' ' A' 3599 ' ' PHE . 53.3 tp -63.01 -44.76 95.11 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.476 178.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.572 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 58.9 mtpt -56.4 -58.18 9.1 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.67 177.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.44 -33.46 75.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.702 -175.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.597 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.62 -46.44 6.63 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -171.792 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.519 ' HB2' HD12 ' A' 3595 ' ' LEU . 19.8 m-85 -99.71 -50.46 4.04 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.79 0.329 . . . . 0.0 111.339 -173.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.572 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 23.4 mm -62.61 -52.6 57.76 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.032 -176.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 75.3 m -59.49 -45.25 92.23 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.037 178.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.718 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -66.6 -56.34 11.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.568 -178.14 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.718 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -55.18 -44.3 75.12 Favored 'General case' 0 CA--C 1.518 -0.281 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -175.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -73.85 -34.23 64.42 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.685 -176.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.76 -38.4 80.07 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-O 121.207 0.527 . . . . 0.0 110.646 179.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -77.69 -18.64 56.41 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.445 178.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 50.72 53.74 12.45 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.484 -169.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.584 ' O ' HD12 ' A' 3603 ' ' LEU . . . -136.26 -175.53 4.02 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.734 -172.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.76 ' HB3' ' HB3' ' A' 3553 ' ' MET . . . -120.47 121.33 38.24 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.678 177.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . 0.521 ' N ' HD11 ' A' 3603 ' ' LEU . . . -63.92 101.53 0.49 Allowed Glycine 0 C--O 1.222 -0.654 0 C-N-CA 120.654 -0.784 . . . . 0.0 111.142 177.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.664 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 29.3 mm -89.97 125.58 42.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-O 121.192 0.52 . . . . 0.0 110.928 -174.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.688 HD13 ' HB3' ' A' 3547 ' ' LEU . 41.1 mt -124.63 117.32 50.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-N 115.428 -0.805 . . . . 0.0 109.714 177.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 11.4 m120 -83.34 141.81 31.51 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.285 -175.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.527 HG11 ' HA ' ' A' 3537 ' ' SER . 58.8 t -136.85 125.72 15.2 Favored Pre-proline 0 C--N 1.326 -0.415 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.458 178.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.527 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 71.7 Cg_endo -92.39 145.37 2.73 Favored 'Trans proline' 0 N--CA 1.45 -1.077 0 C-N-CA 122.67 2.247 . . . . 0.0 112.362 173.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.537 ' HB2' ' HB3' ' A' 3620 ' ' ASN . 0.9 OUTLIER -117.62 75.89 9.85 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 172.605 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.31 118.71 4.58 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.482 2.788 . . . . 0.0 113.336 -170.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 104.25 -44.1 1.54 Allowed Glycine 0 N--CA 1.444 -0.828 0 CA-C-N 115.524 -0.762 . . . . 0.0 112.49 176.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 17.2 m -98.66 -31.58 11.85 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.811 0.338 . . . . 0.0 111.334 -175.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . 0.537 ' HB3' ' HB2' ' A' 3616 ' ' ASN . 9.9 t-20 -150.6 -174.79 4.87 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 -178.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.857 ' HB3' ' HD2' ' A' 3622 ' ' PRO . 27.0 mt-30 -106.44 -178.86 0.64 Allowed Pre-proline 0 C--N 1.318 -0.789 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.857 ' HD2' ' HB3' ' A' 3621 ' ' GLN . 41.1 Cg_endo -68.51 25.18 0.14 Allowed 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 122.969 2.446 . . . . 0.0 112.281 170.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . 0.515 ' H ' ' C ' ' A' 3621 ' ' GLN . . . -80.14 12.33 2.91 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.682 -173.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.516 ' HB2' ' O ' ' A' 3614 ' ' VAL . 68.0 m-85 -89.5 132.55 34.99 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-O 121.441 0.639 . . . . 0.0 109.6 177.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.564 HG12 ' HG3' ' A' 3627 ' ' GLN . 6.1 t -131.67 113.18 22.18 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.182 0 CA-C-N 114.737 -1.12 . . . . 0.0 110.016 -176.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.659 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -92.31 111.52 23.12 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 171.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.564 ' HG3' HG12 ' A' 3625 ' ' VAL . 50.2 mt-30 -94.33 110.28 22.05 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.757 -177.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.606 HG12 HG12 ' A' 3659 ' ' ILE . 46.8 mt -93.72 97.66 7.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.906 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.184 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -87.92 143.64 33.6 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.905 178.699 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.466 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 42.9 Cg_endo -67.58 171.07 12.49 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.554 2.169 . . . . 0.0 111.396 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.52 41.66 0.53 Allowed 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 122.844 2.363 . . . . 0.0 112.816 178.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 15.4 p -75.7 161.7 28.85 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.919 -179.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . 0.427 ' OE2' ' HB2' ' A' 3637 ' ' SER . 4.4 tm-20 -48.85 -44.23 39.46 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.763 -179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 21.3 t80 -49.38 -49.85 42.85 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.477 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.5 m -63.56 -54.96 27.89 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.962 -177.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . 0.432 ' HA ' HD12 ' A' 3639 ' ' LEU . 3.7 mm-40 -62.5 -34.25 76.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.993 -175.399 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . 0.427 ' HB2' ' OE2' ' A' 3633 ' ' GLU . 34.2 t -61.22 -50.52 72.76 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.701 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . 0.408 ' HB3' HD12 ' A' 3642 ' ' LEU . 38.9 m-70 -65.28 -35.46 81.08 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.066 178.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . 0.446 HD13 HD12 ' A' 3650 ' ' ILE . 88.5 mt -63.89 -39.2 93.62 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.977 177.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 1.034 ' HA ' HD22 ' A' 3647 ' ' LEU . 33.6 t -59.72 -37.52 79.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.173 0.511 . . . . 0.0 110.718 177.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 31.6 mtp180 -83.88 -37.66 22.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.28 -179.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.804 HD13 HD22 ' A' 3575 ' ' LEU . 23.5 mt -87.69 -31.13 19.88 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -172.273 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.439 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -154.66 87.34 3.43 Favored Pre-proline 0 N--CA 1.465 0.311 0 CA-C-O 120.784 0.326 . . . . 0.0 111.659 -179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -74.76 -21.75 16.12 Favored 'Trans proline' 0 CA--C 1.532 0.389 0 C-N-CA 122.577 2.185 . . . . 0.0 113.783 -175.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.25 -53.09 10.48 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 120.394 -0.523 . . . . 0.0 109.842 -175.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.757 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -71.06 -26.44 63.08 Favored 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 1.034 HD22 ' HA ' ' A' 3640 ' ' SER . 25.2 tp -53.27 -49.69 66.4 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.353 175.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -58.1 -27.2 63.48 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.016 0.436 . . . . 0.0 110.846 -178.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.459 ' HB3' ' HB ' ' A' 3496 ' ' VAL . 13.6 m -77.85 -45.15 25.14 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.243 178.02 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.626 ' HA ' HG22 ' A' 3653 ' ' ILE . 3.8 pt -73.87 -20.13 17.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.82 0.343 . . . . 0.0 111.566 -175.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.5 m -58.09 -28.21 64.39 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.968 0.413 . . . . 0.0 110.309 175.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -88.51 -34.5 17.4 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.737 175.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.626 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.3 tp -104.99 42.68 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 122.662 1.22 . . . . 0.0 109.014 -179.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.492 ' N ' ' HD2' ' A' 3655 ' ' PRO . 5.4 p -40.1 -38.0 0.95 Allowed Pre-proline 0 CA--C 1.54 0.587 0 CA-C-N 113.61 -1.632 . . . . 0.0 114.216 172.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' 3654 ' ' SER . 19.4 Cg_endo -62.95 78.57 0.11 Allowed 'Trans proline' 0 C--N 1.359 1.113 0 CA-C-N 120.832 1.333 . . . . 0.0 111.415 169.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . 0.469 ' HB2' HD23 ' A' 3579 ' ' LEU . 20.5 p80 -148.19 176.17 10.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.061 -177.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.486 HD22 HG22 ' A' 3628 ' ' ILE . 28.0 mt -122.49 152.34 40.41 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.204 178.835 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 13.4 tmm? -115.34 113.24 23.54 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 175.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.851 HD12 HD21 ' A' 3524 ' ' LEU . 80.9 mt -107.55 123.2 62.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.639 0 CA-C-O 121.35 0.595 . . . . 0.0 111.971 -170.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.853 HG13 ' HD2' ' A' 3573 ' ' TYR . 78.9 t -108.25 112.7 41.41 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.644 -179.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.659 HG12 ' HG ' ' A' 3626 ' ' LEU . 58.1 mt -90.57 112.33 24.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 109.728 -0.471 . . . . 0.0 109.728 177.679 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -128.35 143.46 51.01 Favored 'General case' 0 C--N 1.316 -0.883 0 C-N-CA 120.508 -0.477 . . . . 0.0 111.437 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 14.6 m -94.42 107.97 19.91 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 171.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 42.8 t . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.455 -0.783 . . . . 0.0 110.193 -178.311 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.531 ' CD1' ' HB2' ' A' 3553 ' ' MET . 64.7 m-85 . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 119.677 -0.201 . . . . 0.0 111.403 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.621 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.8 OUTLIER 56.93 -160.9 0.22 Allowed 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.526 0.679 . . . . 0.0 111.391 179.233 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.417 ' H ' ' HB3' ' B' 2519 ' ' GLU . 19.2 m -146.53 115.9 7.07 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 166.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.63 ' HG ' ' N ' ' B' 2522 ' ' SEP . 20.3 tp -78.06 -126.76 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 119.962 -0.695 . . . . 0.0 110.817 -176.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.708 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 26.0 t70 -166.69 -75.43 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.579 174.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 . . . . . 0 C--O 1.252 1.208 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 -177.76 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . . . . . . . . . 47.8 t . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.798 0.333 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 17.0 t70 -104.95 113.73 27.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.876 0.369 . . . . 0.0 110.557 179.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 50.8 mtm -81.63 -21.44 38.24 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.676 -178.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.474 ' HA ' HD12 ' A' 3502 ' ' LEU . 22.7 t -63.46 -24.92 37.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.42 -174.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . 0.441 ' HA ' ' OE1' ' A' 3500 ' ' GLN . 14.7 mm-40 -77.17 -55.76 5.15 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-O 121.013 0.435 . . . . 0.0 110.859 174.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.578 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp -70.06 -32.99 71.36 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -171.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.603 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.27 -15.55 62.92 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.818 -175.91 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.603 ' N ' HD13 ' A' 3502 ' ' LEU . 18.9 ttpp -65.21 -25.14 67.57 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.528 -0.76 . . . . 0.0 109.563 176.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -105.57 -42.14 5.28 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 115.602 -0.726 . . . . 0.0 110.745 175.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.671 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -150.27 108.75 3.19 Favored Pre-proline 0 CA--C 1.536 0.411 0 CA-C-O 121.38 0.609 . . . . 0.0 111.445 -178.624 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -85.49 174.54 6.79 Favored 'Trans proline' 0 CA--C 1.534 0.489 0 C-N-CA 124.221 3.281 . . . . 0.0 113.798 -179.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.517 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 78.6 mt -72.14 134.46 29.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.03 -179.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.444 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.5 m -101.25 -31.92 3.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.504 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.638 ' CB ' HD13 ' A' 3538 ' ' LEU . 34.8 t-105 -149.08 152.53 36.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.745 0.307 . . . . 0.0 110.566 -177.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -145.51 118.18 8.62 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.631 -0.878 . . . . 0.0 108.631 175.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.75 -134.51 1.72 Allowed Glycine 0 N--CA 1.447 -0.631 0 N-CA-C 111.379 -0.688 . . . . 0.0 111.379 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.61 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.3 mp -139.76 151.35 45.73 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.296 0.569 . . . . 0.0 111.532 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.478 HD23 ' HB2' ' A' 3547 ' ' LEU . 73.9 mt -105.45 151.97 23.58 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 170.532 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.677 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.91 125.15 12.97 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.644 0.259 . . . . 0.0 111.572 -178.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.753 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -137.97 142.9 40.48 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 173.966 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.753 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 57.47 -93.39 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.368 0 O-C-N 123.496 0.497 . . . . 0.0 109.755 -169.838 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -140.65 7.33 2.1 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 177.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.42 ' HB3' ' HB1' ' A' 3598 ' ' ALA . 7.3 m-20 -95.09 144.14 25.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.059 -174.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 17.8 p -132.28 144.12 50.37 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 120.963 0.411 . . . . 0.0 111.472 -177.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -139.63 113.82 8.94 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.774 175.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.61 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.29 112.82 9.7 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 177.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 26.9 m -125.06 147.78 29.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 CA-C-O 121.623 0.725 . . . . 0.0 112.237 -173.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . 0.523 HE21 ' HB3' ' A' 3581 ' ' CYS . 10.6 pt20 -106.03 132.72 51.78 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 114.604 -1.18 . . . . 0.0 108.577 172.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.855 HD21 HD12 ' A' 3659 ' ' ILE . 1.1 mt -104.66 109.11 20.91 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.437 0.637 . . . . 0.0 111.738 -175.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.517 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 76.3 m-70 -84.42 138.44 32.83 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.106 -0.952 . . . . 0.0 108.638 175.485 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.671 ' O ' ' HB2' ' A' 3505 ' ' TYR . 61.5 t80 -68.05 137.46 55.05 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 174.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.552 ' CG1' HD23 ' A' 3575 ' ' LEU . 19.8 t -114.8 -56.76 4.02 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.281 0.562 . . . . 0.0 111.1 177.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . . . . . . . . . 22.7 t -160.57 171.5 18.84 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.422 -173.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.45 -148.02 20.36 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.719 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.592 ' HB2' ' HA ' ' A' 3571 ' ' THR . 38.1 t30 -108.63 116.77 32.6 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.744 0.307 . . . . 0.0 110.975 -178.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 28.4 p-10 -68.67 -23.53 64.41 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.167 -176.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . 0.451 ' O ' ' HG2' ' A' 3536 ' ' ARG . 90.0 t -59.71 -36.29 64.89 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.876 0.37 . . . . 0.0 110.313 177.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.51 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 59.1 mt -59.33 -37.42 77.76 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.874 178.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.43 ' HB1' ' CD1' ' A' 3538 ' ' LEU . . . -69.47 -41.4 76.25 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.619 -179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 15.6 t60 -60.39 -36.26 77.68 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.414 -0.357 . . . . 0.0 111.151 -177.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' 3532 ' ' VAL . 12.5 ptp180 -89.13 -26.66 21.21 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.2 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.626 ' O ' HG11 ' A' 3614 ' ' VAL . 72.8 p -86.72 -38.94 16.48 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.119 0.485 . . . . 0.0 110.904 -178.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.638 HD13 ' CB ' ' A' 3509 ' ' TRP . 22.0 mt -81.51 123.57 80.83 Favored Pre-proline 0 C--N 1.316 -0.855 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . 0.91 ' HB2' ' HD2' ' A' 3545 ' ' PRO . 6.2 Cg_endo -72.44 120.08 6.52 Favored 'Trans proline' 0 N--CA 1.448 -1.154 0 C-N-CA 121.801 1.667 . . . . 0.0 111.383 -178.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.514 ' HB3' ' CZ3' ' A' 3509 ' ' TRP . 1.6 pp -156.45 -178.21 7.16 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.34 -172.798 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 70.5 m 71.1 -0.23 3.15 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 123.554 0.742 . . . . 0.0 112.455 178.423 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -172.84 97.73 0.13 Allowed 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.384 0.612 . . . . 0.0 110.782 178.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 83.98 -60.96 4.8 Favored Glycine 0 N--CA 1.45 -0.429 0 CA-C-N 115.918 -0.583 . . . . 0.0 112.409 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 72.41 67.71 1.77 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 121.177 -0.535 . . . . 0.0 112.164 -178.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.91 ' HD2' ' HB2' ' A' 3539 ' ' PRO . 17.5 Cg_exo -65.99 154.8 72.54 Favored 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.809 2.339 . . . . 0.0 112.395 -178.477 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -66.58 145.83 77.51 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.499 2.132 . . . . 0.0 112.186 177.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.689 ' HB3' HD13 ' A' 3612 ' ' ILE . 49.9 mt -81.82 112.74 19.24 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.261 177.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.677 ' HA ' ' O ' ' A' 3514 ' ' ALA . 21.7 ptt85 -90.34 141.51 28.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.871 0.367 . . . . 0.0 111.196 -177.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.522 HG22 HD12 ' B' 2521 ' ' LEU . 20.2 mt -95.02 107.14 19.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-O 121.865 0.841 . . . . 0.0 110.636 179.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.476 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -110.83 -4.15 15.39 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.594 -172.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.66 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 52.9 mt-30 -150.97 176.49 11.07 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.955 -0.111 . . . . 0.0 111.022 -179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.768 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -160.38 140.13 11.13 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -177.78 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.579 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 12.9 tmm? -112.4 125.21 53.96 Favored 'General case' 0 C--O 1.218 -0.574 0 CA-C-N 116.72 -0.218 . . . . 0.0 110.641 177.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' 3554 ' ' ARG . 13.6 mmt85 -68.82 110.3 4.29 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 -179.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.597 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -72.35 98.57 2.25 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 122.293 1.045 . . . . 0.0 110.318 -175.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.58 ' O ' ' HG ' ' A' 3560 ' ' LEU . 37.8 mt-10 -106.24 156.88 18.02 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.492 177.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.503 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -53.96 -50.24 66.95 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.125 0.266 . . . . 0.0 111.295 -177.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 18.7 p -63.98 -42.54 97.21 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.905 0.383 . . . . 0.0 111.246 179.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.505 ' O ' HG23 ' A' 3563 ' ' VAL . 80.9 mm-40 -61.37 -42.46 98.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.078 179.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.58 HD21 ' HB2' ' A' 3555 ' ' LEU . 94.0 mt -65.18 -31.9 73.31 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.199 -178.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' 3557 ' ' ALA . 22.4 mm-40 -66.78 -45.27 79.02 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.214 0.53 . . . . 0.0 109.636 175.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -57.66 -41.75 93.89 Favored Glycine 0 CA--C 1.519 0.291 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.036 174.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.581 ' O ' ' HG3' ' A' 3567 ' ' MET . 97.1 t -61.94 -46.75 95.81 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-O 120.843 0.354 . . . . 0.0 110.207 177.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -62.61 -25.48 68.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.541 -179.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.464 ' O ' HG22 ' A' 3568 ' ' THR . 41.5 ttm105 -63.61 -34.58 78.15 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.64 178.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . 0.549 ' HG2' ' O ' ' A' 3563 ' ' VAL . 10.5 ptp180 -86.45 -18.97 30.34 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.19 0.519 . . . . 0.0 109.889 176.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.581 ' HG3' ' O ' ' A' 3563 ' ' VAL . 90.0 mtp -75.44 -22.29 57.47 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.917 -177.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . 0.464 HG22 ' O ' ' A' 3565 ' ' ARG . 6.1 t -80.22 -8.65 59.55 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.126 0.489 . . . . 0.0 110.25 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.4 t -113.16 89.65 1.34 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.354 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -71.91 110.45 6.42 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.072 -179.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.592 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 3.3 m 147.48 -39.36 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 125.894 1.677 . . . . 0.0 107.819 -177.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -79.02 -30.79 44.4 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.665 -179.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.806 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -133.43 167.14 20.97 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.068 178.464 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.637 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 35.2 t -128.11 137.06 51.97 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 172.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.763 HD22 HD13 ' A' 3642 ' ' LEU . 14.1 tp -106.43 125.52 51.1 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.622 HD11 HD11 ' A' 3661 ' ' ILE . 80.3 mt -128.23 155.22 44.89 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.177 0.513 . . . . 0.0 110.899 -177.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.729 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -122.12 108.53 13.45 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.407 179.367 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.465 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -95.0 125.91 39.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.289 0.566 . . . . 0.0 110.706 -178.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.51 HD23 ' HB2' ' A' 3656 ' ' HIS . 75.3 mt -125.24 144.44 47.48 Favored Pre-proline 0 C--N 1.322 -0.593 0 CA-C-N 114.873 -1.058 . . . . 0.0 110.242 -179.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -61.87 112.22 1.44 Allowed 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.347 2.031 . . . . 0.0 111.874 178.137 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . 0.523 ' HB3' HE21 ' A' 3523 ' ' GLN . 26.4 p -104.7 120.61 41.75 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.868 0.366 . . . . 0.0 110.345 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . 0.4 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.07 145.17 16.19 Favored Glycine 0 N--CA 1.443 -0.865 0 C-N-CA 120.555 -0.831 . . . . 0.0 112.849 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . . . . . . . . . 51.8 mtt85 -67.13 -38.55 85.76 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.743 0.782 . . . . 0.0 109.465 176.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.598 ' O ' HG23 ' A' 3588 ' ' VAL . 29.1 t70 -136.73 169.68 17.34 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 114.524 -1.216 . . . . 0.0 107.808 177.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 49.4 tp60 -56.65 -37.1 70.31 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.287 0.494 . . . . 0.0 110.512 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -60.72 -46.55 89.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.285 0.564 . . . . 0.0 109.509 176.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.439 ' HB3' ' H ' ' A' 3584 ' ' ASP . 23.4 t70 -64.37 -42.54 96.12 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.785 179.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.598 HG23 ' O ' ' A' 3584 ' ' ASP . 89.6 t -54.76 -47.49 74.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.776 179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 87.8 t -58.95 -49.44 83.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.385 178.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 23.0 t -60.07 -48.91 79.75 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.765 -179.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -63.37 -37.83 88.8 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.859 -0.155 . . . . 0.0 111.413 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 66.5 m -61.51 -52.0 66.28 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.068 0.461 . . . . 0.0 110.484 179.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.521 ' HA ' ' HG2' ' A' 3596 ' ' LYS . 26.9 mt-10 -68.55 -38.66 80.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.886 -179.293 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 18.3 t -58.03 -49.65 76.14 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.136 177.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.572 HD12 ' HB2' ' A' 3599 ' ' PHE . 57.8 tp -62.5 -46.69 87.3 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.327 -178.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.818 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 65.7 pttt -70.35 -33.85 71.95 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.267 -0.573 . . . . 0.0 111.143 -175.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -77.82 -37.34 48.84 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 121.041 -0.264 . . . . 0.0 111.709 178.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.42 ' HB1' ' HB3' ' A' 3518 ' ' ASP . . . -91.96 -46.95 7.55 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -172.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.572 ' HB2' HD12 ' A' 3595 ' ' LEU . 14.8 m-85 -98.7 -49.74 4.49 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.637 0.256 . . . . 0.0 111.294 -174.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.818 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 25.1 mm -60.55 -55.31 25.31 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.708 -178.367 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 64.2 m -57.63 -38.46 75.03 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.208 -179.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.744 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -68.84 -57.11 6.02 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.866 178.522 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.744 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.22 -41.91 76.4 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.569 0.223 . . . . 0.0 111.55 -177.212 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -72.05 -36.93 69.76 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.703 -177.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -68.33 -36.95 80.04 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.053 0.454 . . . . 0.0 110.758 179.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -79.61 -18.31 51.85 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.87 178.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . 0.537 ' O ' ' HG ' ' A' 3555 ' ' LEU . 22.7 mt-30 51.92 48.31 23.02 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -171.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.574 ' O ' HD12 ' A' 3603 ' ' LEU . . . -130.24 -175.93 3.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.295 -171.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.768 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.71 117.73 28.24 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.499 175.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . 0.439 ' N ' HD11 ' A' 3603 ' ' LEU . . . -66.21 105.4 1.27 Allowed Glycine 0 C--O 1.222 -0.641 0 C-N-CA 120.837 -0.696 . . . . 0.0 111.896 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.66 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 35.4 mm -89.69 125.91 42.62 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.223 0.535 . . . . 0.0 111.22 -175.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.689 HD13 ' HB3' ' A' 3547 ' ' LEU . 28.1 mt -121.23 114.72 44.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.793 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.302 178.001 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.533 ' HA ' ' O ' ' A' 3624 ' ' TYR . 12.9 m120 -88.74 127.96 35.61 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.359 179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.626 HG11 ' O ' ' A' 3537 ' ' SER . 4.8 t -126.37 135.32 27.02 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.187 -177.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.443 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 79.6 Cg_endo -84.39 136.96 6.78 Favored 'Trans proline' 0 N--CA 1.451 -0.987 0 C-N-CA 122.103 1.869 . . . . 0.0 111.687 168.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.764 ' HB2' ' HE2' ' A' 3624 ' ' TYR . 26.1 t-20 -66.97 126.91 93.22 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.378 -179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' 3616 ' ' ASN . 32.0 Cg_exo -58.62 102.97 0.15 Allowed 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 122.974 2.449 . . . . 0.0 112.419 -178.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 109.34 -29.28 9.74 Favored Glycine 0 N--CA 1.448 -0.526 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.882 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . 0.674 ' HB3' ' HB3' ' A' 3616 ' ' ASN . 29.5 t -94.97 -30.02 14.34 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.928 0.394 . . . . 0.0 110.135 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 63.2 t30 69.68 7.0 6.0 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.406 -0.815 . . . . 0.0 111.304 178.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.428 ' O ' ' HA ' ' A' 3615 ' ' PRO . 26.6 mt-30 -78.73 115.1 49.27 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.41 177.579 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.535 ' HA ' ' O ' ' A' 3614 ' ' VAL . 71.7 Cg_endo -87.85 23.97 0.75 Allowed 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 123.355 2.704 . . . . 0.0 112.618 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -78.95 44.04 0.54 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.947 -0.57 . . . . 0.0 111.363 -178.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.764 ' HE2' ' HB2' ' A' 3616 ' ' ASN . 72.7 m-85 -123.86 133.56 53.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.044 0.449 . . . . 0.0 110.506 178.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.406 HG13 HG23 ' A' 3611 ' ' ILE . 4.3 t -126.67 114.07 36.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.851 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.619 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -98.42 114.88 27.4 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 169.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.515 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 65.4 mt-30 -94.5 110.92 22.68 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 -179.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.605 HG12 HG12 ' A' 3659 ' ' ILE . 39.2 mt -92.38 98.7 8.67 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.279 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -88.55 142.59 31.2 Favored Pre-proline 0 C--N 1.319 -0.753 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.917 177.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.507 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 48.2 Cg_endo -68.98 172.96 10.96 Favored 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 122.578 2.185 . . . . 0.0 111.308 176.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . 0.401 ' HD3' HD12 ' A' 3600 ' ' ILE . 56.4 Cg_endo -70.35 45.23 0.51 Allowed 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 123.078 2.519 . . . . 0.0 112.276 176.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.7 p -84.39 163.35 19.57 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.982 -178.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -42.62 -49.85 5.47 Favored 'General case' 0 C--N 1.331 -0.232 0 O-C-N 123.959 0.787 . . . . 0.0 112.02 179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . 0.506 ' HB2' HD13 ' A' 3560 ' ' LEU . 38.6 t80 -50.82 -48.12 59.82 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 123.339 0.399 . . . . 0.0 111.487 -179.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 9.7 m -68.15 -58.43 4.47 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.629 -176.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -60.93 -41.15 95.66 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.427 -173.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 9.0 t -66.19 -44.97 82.42 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 120.927 0.394 . . . . 0.0 110.243 -177.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 19.7 m80 -68.87 -30.13 68.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.629 178.726 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 68.9 mt -66.01 -40.66 91.28 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.536 -0.302 . . . . 0.0 110.846 175.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.475 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 32.7 t -67.1 -25.55 66.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.15 0.5 . . . . 0.0 110.181 177.47 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -83.86 -38.6 20.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.189 -179.606 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.763 HD13 HD22 ' A' 3575 ' ' LEU . 12.7 mt -94.91 -31.4 13.69 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 -172.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -149.08 75.27 9.82 Favored Pre-proline 0 C--N 1.326 -0.427 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -175.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -67.91 -18.75 46.77 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.788 2.325 . . . . 0.0 111.782 179.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . 0.531 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 2.7 m-20 -71.11 -49.95 38.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.196 -177.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.729 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -83.05 -29.11 29.1 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.444 178.818 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.475 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.35 -43.83 71.64 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.97 0.414 . . . . 0.0 110.45 179.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -67.14 -18.46 65.3 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.233 -0.44 . . . . 0.0 112.098 -176.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 89.1 p -91.49 -26.19 18.92 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.227 177.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.627 ' HA ' HG22 ' A' 3653 ' ' ILE . 7.1 pt -88.07 -10.44 10.82 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 C-N-CA 120.747 -0.381 . . . . 0.0 111.558 -177.03 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 15.2 p -58.58 -23.93 59.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.875 175.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 5.3 t30 -85.9 -36.51 19.88 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.094 0.473 . . . . 0.0 110.206 175.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.627 HG22 ' HA ' ' A' 3650 ' ' ILE . 9.4 tp -104.47 38.95 0.25 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 CA-C-O 122.379 1.085 . . . . 0.0 109.789 -178.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.442 ' N ' ' HD2' ' A' 3655 ' ' PRO . 50.7 m -36.78 -42.24 0.81 Allowed Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 114.157 -1.383 . . . . 0.0 113.947 170.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.451 ' HG2' HD12 ' A' 3653 ' ' ILE . 12.9 Cg_endo -59.75 77.44 0.06 OUTLIER 'Trans proline' 0 C--N 1.357 1.008 0 C-N-CA 121.533 1.489 . . . . 0.0 111.517 168.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . 0.51 ' HB2' HD23 ' A' 3579 ' ' LEU . 22.5 p80 -147.69 174.89 11.35 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.776 -177.165 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.479 HD22 HG22 ' A' 3628 ' ' ILE . 42.9 mt -120.76 149.85 41.91 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.525 179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 16.2 tmm? -113.98 114.54 26.31 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.855 HD12 HD21 ' A' 3524 ' ' LEU . 74.8 mt -108.38 121.22 61.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.169 0.509 . . . . 0.0 111.811 -170.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.806 HG13 ' HD2' ' A' 3573 ' ' TYR . 76.1 t -105.34 114.77 45.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.353 -0.84 . . . . 0.0 110.918 -178.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.637 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 57.5 mt -91.15 118.45 36.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.314 178.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.5 127.66 55.77 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.654 0.264 . . . . 0.0 110.615 178.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . 0.421 ' HB2' HD22 ' A' 3533 ' ' LEU . 33.6 t -91.73 122.35 34.2 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.41 179.712 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 C--O 1.251 1.154 0 CA-C-O 117.337 -1.316 . . . . 0.0 112.693 178.221 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.579 ' CD1' ' HB2' ' A' 3553 ' ' MET . 8.9 m-85 . . . . . 0 N--CA 1.481 1.121 0 N-CA-C 111.619 0.229 . . . . 0.0 111.619 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.613 ' O ' ' HG2' ' A' 3551 ' ' GLN . 4.5 tt0 58.44 -155.81 0.34 Allowed 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 177.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.571 ' H ' ' CG ' ' B' 2519 ' ' GLU . 58.5 m -155.07 121.87 5.42 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 175.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.588 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER -84.53 -130.12 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 179.252 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.66 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -162.4 -156.28 0.4 Allowed 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 178.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 44.1 tt0 . . . . . 0 C--O 1.247 0.941 0 CA-C-O 118.803 -0.617 . . . . 0.0 110.463 -179.953 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.407 HG11 ' HB1' ' A' 3648 ' ' ALA . 7.3 m . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 121.811 0.815 . . . . 0.0 110.933 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . 0.405 ' OD1' HG23 ' A' 3499 ' ' VAL . 10.8 t70 -87.38 154.57 20.56 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.062 -178.161 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . 0.526 ' O ' HD12 ' A' 3502 ' ' LEU . 38.2 ttp -62.3 -26.53 68.47 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-N 116.788 -0.187 . . . . 0.0 110.772 -179.154 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.466 ' HA ' HD12 ' A' 3502 ' ' LEU . 97.8 t -56.24 -25.0 19.19 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 121.183 0.516 . . . . 0.0 110.815 177.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -79.6 -58.76 3.03 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.264 174.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.584 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.4 pp -66.55 -36.93 83.87 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -172.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.655 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -69.4 -15.32 63.27 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.131 0.491 . . . . 0.0 110.163 -172.582 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.655 ' N ' HD13 ' A' 3502 ' ' LEU . 21.6 tptm -77.9 -25.92 48.79 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 109.449 -0.575 . . . . 0.0 109.449 177.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.491 ' HG3' ' OD2' ' A' 3645 ' ' ASP . 31.5 mmtp -89.44 -43.14 11.07 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.737 -0.665 . . . . 0.0 109.706 175.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.733 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -153.74 104.17 2.51 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.092 -0.958 . . . . 0.0 110.18 179.598 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -84.01 174.12 8.58 Favored 'Trans proline' 0 CA--C 1.53 0.318 0 C-N-CA 124.085 3.19 . . . . 0.0 114.091 -174.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.511 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 91.8 mt -71.39 135.69 27.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.115 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.414 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.7 m -104.75 -29.57 2.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.292 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.717 ' HE3' HD12 ' A' 3524 ' ' LEU . 45.4 t90 -150.02 155.36 39.78 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -150.9 127.12 10.57 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . 177.93 -125.81 1.03 Allowed Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.824 -0.703 . . . . 0.0 111.539 -179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.668 ' O ' ' HA ' ' A' 3546 ' ' PRO . 5.3 mp -141.01 158.54 43.79 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.089 0.471 . . . . 0.0 111.098 -179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.51 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 79.7 mt -112.05 152.55 28.07 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 169.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.62 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -144.85 123.31 12.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.802 0.334 . . . . 0.0 111.836 -177.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.782 HD12 ' CD ' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.42 142.12 39.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 172.957 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.782 ' CD ' HD12 ' A' 3515 ' ' LEU . 0.5 OUTLIER 60.4 -91.6 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 122.788 0.435 . . . . 0.0 110.034 -171.385 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 45.7 m-80 -142.98 7.04 1.6 Allowed 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.16 176.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -99.73 138.04 37.36 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.714 -174.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.515 HG22 ' HB2' ' A' 3514 ' ' ALA . 15.3 p -128.86 127.82 42.63 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.748 -177.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -119.96 120.88 37.64 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.745 176.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.638 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -75.48 117.05 16.86 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.414 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 30.2 m -129.95 148.36 33.2 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-O 121.417 0.627 . . . . 0.0 111.974 -174.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -110.29 128.71 55.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.259 -0.882 . . . . 0.0 108.872 172.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.866 HD21 HD12 ' A' 3659 ' ' ILE . 1.5 mt -95.6 113.02 24.62 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.91 -0.586 . . . . 0.0 112.186 -174.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.527 ' CE1' HD12 ' A' 3579 ' ' LEU . 70.2 m80 -88.45 141.79 28.25 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.07 -0.968 . . . . 0.0 108.785 175.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.733 ' O ' ' HB2' ' A' 3505 ' ' TYR . 64.3 t80 -71.77 139.71 49.15 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 172.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.582 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.4 t -115.23 -57.59 3.75 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.461 0.648 . . . . 0.0 110.719 176.081 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.521 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 68.9 m -159.42 171.77 19.13 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.175 -171.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.57 -149.06 20.33 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.478 -0.868 . . . . 0.0 112.792 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.482 ' HB2' ' HA ' ' A' 3571 ' ' THR . 27.4 t-20 -104.64 110.55 22.91 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 122.211 0.204 . . . . 0.0 110.664 -177.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 8.9 p30 -63.17 -30.93 71.98 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.538 -176.555 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 19.1 t -59.92 -33.47 52.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-O 120.88 0.372 . . . . 0.0 110.028 -179.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.445 ' HB2' ' O ' ' A' 3530 ' ' ASN . 17.8 mt -56.71 -48.33 77.96 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.235 175.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.445 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.13 -38.23 89.95 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-O 121.413 0.625 . . . . 0.0 110.23 -178.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 16.4 m-70 -62.52 -40.21 96.03 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.27 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' 3536 ' ' ARG . 11.4 ptt180 -89.38 -10.01 48.19 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.979 0.733 . . . . 0.0 112.979 -179.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.427 ' HB2' HD11 ' A' 3626 ' ' LEU . 29.8 p -98.9 -41.82 7.43 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 122.015 -0.428 . . . . 0.0 111.506 -179.706 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.683 HD13 ' HB2' ' A' 3509 ' ' TRP . 29.8 mt -78.84 111.27 18.4 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-O 121.142 0.496 . . . . 0.0 110.063 -173.533 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -74.21 152.54 45.14 Favored 'Trans proline' 0 N--CA 1.46 -0.445 0 C-N-CA 123.078 2.519 . . . . 0.0 112.474 -172.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.502 ' O ' HD12 ' A' 3540 ' ' LEU . 2.2 pp -169.54 138.6 1.95 Allowed 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.728 178.512 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 31.8 t -140.51 -44.32 0.4 Allowed 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -136.96 95.99 3.22 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.807 177.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 78.25 -105.28 2.14 Favored Glycine 0 N--CA 1.448 -0.521 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.924 -175.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -155.73 103.33 0.23 Allowed Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.089 -179.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.417 ' CD ' ' HA ' ' A' 3540 ' ' LEU . 47.4 Cg_endo -68.88 138.37 40.5 Favored 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.843 2.362 . . . . 0.0 112.1 -178.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.668 ' HA ' ' O ' ' A' 3512 ' ' LEU . 33.8 Cg_endo -64.27 121.71 9.43 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.414 2.076 . . . . 0.0 112.52 -177.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.662 ' HB3' HD13 ' A' 3612 ' ' ILE . 24.4 mt -69.05 115.42 8.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.795 174.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.638 ' HD2' ' OD2' ' B' 2523 ' ' ASP . 20.0 ptt180 -90.31 138.64 31.37 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.29 -0.413 . . . . 0.0 111.06 -176.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.47 ' O ' ' HB3' ' B' 2521 ' ' LEU . 20.8 mt -95.26 106.96 18.87 Favored 'Isoleucine or valine' 0 C--O 1.247 0.949 0 CA-C-O 122.152 0.977 . . . . 0.0 110.865 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.509 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -112.38 -2.05 14.88 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.581 -1.191 . . . . 0.0 111.695 -173.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.699 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 16.1 mt-30 -151.13 174.44 13.21 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 120.459 0.171 . . . . 0.0 111.331 178.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.75 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -157.0 136.43 12.15 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.357 -177.874 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.574 ' HB2' ' CD1' ' B' 2518 ' ' TYR . 11.7 tmm? -110.03 121.11 44.48 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-N 116.606 -0.27 . . . . 0.0 110.288 177.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . 0.436 HH11 ' HD2' ' A' 3554 ' ' ARG . 9.3 mmt180 -63.3 111.35 2.23 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 109.495 -0.557 . . . . 0.0 109.495 179.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.542 ' HB2' HD21 ' A' 3560 ' ' LEU . 2.9 pp -71.84 97.32 1.79 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 122.472 1.13 . . . . 0.0 108.683 178.675 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.484 ' H ' ' HB2' ' A' 3559 ' ' GLN . 6.0 mm-40 -103.9 163.86 12.08 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 114.172 -1.376 . . . . 0.0 109.498 -177.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.527 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -58.45 -45.89 87.66 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.224 0.328 . . . . 0.0 110.18 176.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 44.8 p -66.07 -41.86 90.17 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.107 178.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.583 ' O ' HG23 ' A' 3563 ' ' VAL . 15.4 mm100 -63.45 -49.71 72.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.13 -179.164 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.542 HD21 ' HB2' ' A' 3555 ' ' LEU . 79.7 mt -59.69 -37.51 79.02 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.512 -176.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' 3557 ' ' ALA . 7.4 mm-40 -56.58 -53.35 58.61 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.961 0.41 . . . . 0.0 110.06 175.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -60.89 -41.11 99.15 Favored Glycine 0 N--CA 1.451 -0.352 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.199 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' 3559 ' ' GLN . 91.9 t -60.52 -52.78 57.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.448 0.166 . . . . 0.0 110.635 178.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -61.43 -39.5 91.04 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.787 0.327 . . . . 0.0 111.293 -178.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.541 ' O ' HG22 ' A' 3568 ' ' THR . 98.1 mtt180 -68.05 -27.26 66.37 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.595 -177.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -88.42 -20.08 25.71 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.229 -0.588 . . . . 0.0 110.503 172.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.429 ' SD ' HG12 ' A' 3563 ' ' VAL . 76.8 mtp -74.69 -21.5 59.36 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.739 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . 0.541 HG22 ' O ' ' A' 3565 ' ' ARG . 5.6 t -74.88 -7.32 53.16 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.113 0.483 . . . . 0.0 110.253 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 21.7 t -105.34 87.93 1.13 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.556 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.149 177.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -73.53 108.16 6.22 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.482 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.4 m 155.04 -43.13 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.536 1.535 . . . . 0.0 107.811 -174.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -84.69 -24.96 28.73 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.934 -178.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.688 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -130.16 161.52 30.93 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.053 179.616 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.634 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 47.8 t -124.84 135.83 53.26 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 171.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.764 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.61 125.55 51.11 Favored 'General case' 0 C--N 1.311 -1.094 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.628 HD11 HD11 ' A' 3661 ' ' ILE . 76.8 mt -125.57 153.44 43.69 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.143 0.497 . . . . 0.0 110.951 -177.306 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.598 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -121.94 106.39 11.19 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.501 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.44 123.99 38.19 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.365 0.602 . . . . 0.0 110.24 -177.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.527 HD12 ' CE1' ' A' 3525 ' ' HIS . 79.1 mt -125.48 143.33 44.41 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 114.714 -1.13 . . . . 0.0 110.162 -178.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -61.36 113.33 1.73 Allowed 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.406 2.07 . . . . 0.0 111.637 178.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 28.0 p -100.89 111.69 23.96 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.096 0.474 . . . . 0.0 110.431 -177.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . 0.461 ' H ' HG22 ' A' 3588 ' ' VAL . . . -104.07 146.08 16.23 Favored Glycine 0 N--CA 1.443 -0.876 0 C-N-CA 120.885 -0.674 . . . . 0.0 111.727 177.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' 3583 ' ' ARG . 29.4 ttt180 -60.61 -35.82 77.07 Favored 'General case' 0 N--CA 1.432 -1.345 0 CA-C-O 121.344 0.592 . . . . 0.0 110.92 178.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.585 ' O ' HG23 ' A' 3588 ' ' VAL . 28.1 t70 -140.44 169.54 17.47 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -53.59 -39.85 65.2 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 118.003 0.365 . . . . 0.0 111.181 -178.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -63.39 -44.6 94.24 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.202 0.525 . . . . 0.0 110.603 176.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.451 ' HB3' ' H ' ' A' 3584 ' ' ASP . 12.6 t70 -63.34 -39.73 95.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.908 -179.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.585 HG23 ' O ' ' A' 3584 ' ' ASP . 84.9 t -60.08 -41.48 86.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.945 178.62 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 4.9 t -62.59 -50.34 80.2 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.385 0 CA-C-O 121.555 0.693 . . . . 0.0 109.744 -178.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 37.1 m -59.84 -41.76 92.11 Favored 'General case' 0 N--CA 1.44 -0.964 0 CA-C-N 114.391 -1.277 . . . . 0.0 111.555 179.033 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 62.8 mm-40 -68.63 -38.23 80.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.48 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . 0.437 ' O ' ' HG3' ' A' 3596 ' ' LYS . 86.6 m -58.55 -54.74 43.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.933 -179.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -65.24 -33.4 75.9 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.965 -0.294 . . . . 0.0 111.2 -177.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 66.7 m -63.8 -45.94 87.39 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.846 0.355 . . . . 0.0 110.421 177.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.568 HD12 ' HB2' ' A' 3599 ' ' PHE . 57.6 tp -62.95 -40.7 98.48 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.471 177.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.526 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 55.1 mtpt -58.74 -59.43 5.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.888 178.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -66.63 -29.53 69.59 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -174.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.402 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -95.64 -47.68 6.11 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -173.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.568 ' HB2' HD12 ' A' 3595 ' ' LEU . 23.5 m-85 -100.72 -50.26 3.92 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 111.831 0.308 . . . . 0.0 111.831 -174.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.526 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.4 mm -62.35 -58.59 6.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.893 -175.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 32.5 m -59.63 -31.61 69.67 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.237 -178.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.774 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -72.62 -58.61 3.23 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.812 177.752 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.774 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.2 OUTLIER -56.37 -42.54 78.01 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.567 0.223 . . . . 0.0 111.56 -178.161 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -69.85 -38.15 76.37 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.6 -177.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.22 -40.17 74.7 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.009 0.433 . . . . 0.0 110.499 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -73.98 -19.05 60.78 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.001 178.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . 0.496 ' O ' ' HG ' ' A' 3555 ' ' LEU . 23.5 mt-30 48.72 52.46 13.93 Favored 'General case' 0 C--O 1.23 0.068 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 -169.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.516 ' O ' HD12 ' A' 3603 ' ' LEU . . . -130.96 -175.96 3.85 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.978 -0.556 . . . . 0.0 112.197 -173.055 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.75 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -120.92 117.47 27.43 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.306 175.361 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.39 103.73 0.79 Allowed Glycine 0 C--O 1.222 -0.653 0 C-N-CA 120.722 -0.752 . . . . 0.0 111.338 178.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.699 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.4 mm -89.28 120.23 37.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.207 0.527 . . . . 0.0 111.377 -173.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.662 HD13 ' HB3' ' A' 3547 ' ' LEU . 30.5 mt -122.53 105.29 15.89 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.911 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.825 175.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.529 ' HA ' ' O ' ' A' 3624 ' ' TYR . 5.8 m120 -83.65 125.06 31.45 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.866 178.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 34.5 m -117.15 140.13 26.76 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.443 178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.66 ' HA ' ' O ' ' A' 3621 ' ' GLN . 93.2 Cg_endo -92.99 146.33 2.44 Favored 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 122.558 2.172 . . . . 0.0 112.137 172.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.681 ' HB2' ' HB2' ' A' 3619 ' ' SER . 19.7 m120 -59.61 124.63 76.77 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 172.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 11.7 Cg_endo -55.64 109.83 0.47 Allowed 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.891 2.394 . . . . 0.0 112.63 -177.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 97.97 -21.2 47.31 Favored Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.258 179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . 0.681 ' HB2' ' HB2' ' A' 3616 ' ' ASN . 14.5 m -99.41 -25.43 14.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.761 0.315 . . . . 0.0 110.678 -178.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . 0.412 ' O ' ' HD3' ' A' 3622 ' ' PRO . 6.0 m-20 63.29 29.26 15.84 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.823 177.068 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.66 ' O ' ' HA ' ' A' 3615 ' ' PRO . 75.8 mm-40 -93.68 105.9 18.7 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 176.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.412 ' HD3' ' O ' ' A' 3620 ' ' ASN . 93.0 Cg_endo -87.55 24.83 0.69 Allowed 'Trans proline' 0 N--CA 1.463 -0.305 0 C-N-CA 123.458 2.772 . . . . 0.0 113.164 -174.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -76.41 23.36 0.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.419 0.526 . . . . 0.0 112.419 -174.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.529 ' O ' ' HA ' ' A' 3613 ' ' ASN . 79.3 m-85 -118.04 133.02 56.31 Favored 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 120.829 0.347 . . . . 0.0 110.492 -179.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.517 HG13 HG23 ' A' 3611 ' ' ILE . 9.9 t -122.74 115.75 46.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.237 177.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.663 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.5 mp -95.55 110.03 22.17 Favored 'General case' 0 C--N 1.314 -0.976 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 170.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.495 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 61.5 mt-30 -94.5 110.74 22.51 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.692 -177.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.595 HG12 HG12 ' A' 3659 ' ' ILE . 31.6 mt -89.75 98.27 7.98 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.868 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.126 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -87.54 144.5 35.61 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.875 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.647 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 58.8 Cg_endo -71.7 170.18 19.3 Favored 'Trans proline' 0 N--CA 1.464 -0.23 0 C-N-CA 122.576 2.184 . . . . 0.0 111.404 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . 0.4 ' HD3' ' O ' ' A' 3656 ' ' HIS . 36.9 Cg_endo -67.96 77.61 0.59 Allowed 'Trans proline' 0 C--N 1.345 0.365 0 C-N-CA 122.362 2.041 . . . . 0.0 110.969 174.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . 0.549 ' O ' ' HG2' ' A' 3636 ' ' GLU . 8.4 p -111.95 162.77 14.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.297 -171.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -48.84 -39.28 24.98 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.993 176.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 46.6 t80 -58.18 -55.95 28.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.231 176.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 33.8 p -66.23 -54.16 28.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.481 -174.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . 0.549 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.8 mm-40 -61.32 -35.15 76.58 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.474 -0.33 . . . . 0.0 111.795 -171.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 45.8 m -71.87 -46.0 59.38 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.058 0.456 . . . . 0.0 110.554 -178.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 38.6 m-70 -63.32 -35.67 81.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.148 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 84.0 mt -63.46 -32.9 74.48 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.031 176.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 1.088 ' HA ' HD22 ' A' 3647 ' ' LEU . 17.5 t -65.32 -35.76 81.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.055 0.455 . . . . 0.0 110.08 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.97 -54.71 5.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.012 177.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.764 HD13 HD22 ' A' 3575 ' ' LEU . 28.2 mt -67.23 -39.62 86.26 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.463 -0.789 . . . . 0.0 112.821 -171.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.419 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -147.61 75.24 11.24 Favored Pre-proline 0 C--N 1.327 -0.385 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -176.431 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . 0.524 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 48.9 Cg_endo -69.52 -19.9 36.65 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.412 2.075 . . . . 0.0 111.752 178.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . 0.491 ' OD2' ' HG3' ' A' 3504 ' ' LYS . 43.6 m-20 -70.68 -51.66 26.22 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.026 -177.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.598 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -79.52 -28.01 41.35 Favored 'General case' 0 N--CA 1.444 -0.765 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.419 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 1.088 HD22 ' HA ' ' A' 3640 ' ' SER . 25.4 tp -52.06 -48.47 64.61 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.618 178.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . 0.407 ' HB1' HG11 ' A' 3496 ' ' VAL . . . -61.88 -20.33 63.61 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.492 -176.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 8.3 t -89.58 -33.56 16.66 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.175 178.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.606 ' HA ' HG22 ' A' 3653 ' ' ILE . 6.3 pt -80.81 -16.78 12.44 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.211 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.849 179.152 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 6.1 t -59.88 -21.14 60.62 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.41 0.624 . . . . 0.0 109.685 174.191 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -88.14 -39.21 14.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.353 174.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.606 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -105.22 43.15 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.502 0 CA-C-O 122.461 1.124 . . . . 0.0 109.439 -179.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.471 ' N ' ' HD2' ' A' 3655 ' ' PRO . 20.3 m -37.19 -42.97 1.06 Allowed Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 113.98 -1.464 . . . . 0.0 113.524 172.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.52 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.8 Cg_endo -60.22 82.43 0.07 OUTLIER 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 121.432 1.421 . . . . 0.0 111.661 168.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . 0.414 ' HB2' HD23 ' A' 3579 ' ' LEU . 25.7 p80 -148.18 174.64 11.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.145 -177.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.448 HD22 HG22 ' A' 3628 ' ' ILE . 39.1 mt -120.96 150.34 41.26 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.446 178.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 59.2 ttp -111.82 109.65 19.59 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 173.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.866 HD12 HD21 ' A' 3524 ' ' LEU . 83.5 mt -101.31 114.76 41.51 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 CA-C-O 121.248 0.547 . . . . 0.0 111.19 -173.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.688 HG13 ' HD2' ' A' 3573 ' ' TYR . 72.4 t -101.1 114.54 40.58 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-N 115.34 -0.846 . . . . 0.0 110.799 -177.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.663 HG12 ' HG ' ' A' 3626 ' ' LEU . 57.0 mt -90.51 112.09 24.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 177.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -117.12 129.21 55.82 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 120.882 0.372 . . . . 0.0 111.621 -176.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 27.9 m -103.02 108.45 19.63 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 169.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 48.2 t . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.328 179.36 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.574 ' CD1' ' HB2' ' A' 3553 ' ' MET . 31.0 m-85 . . . . . 0 N--CA 1.482 1.134 0 CA-C-O 119.745 -0.169 . . . . 0.0 111.408 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.534 ' HB2' ' HG2' ' A' 3552 ' ' ARG . 0.5 OUTLIER 53.49 -155.54 0.21 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.761 0.791 . . . . 0.0 111.419 179.143 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.465 ' H ' ' HB3' ' B' 2519 ' ' GLU . 98.5 m -153.14 123.22 6.98 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.577 -1.192 . . . . 0.0 107.996 167.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.573 HD11 ' CD1' ' A' 3515 ' ' LEU . 0.2 OUTLIER -78.52 -134.17 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -177.999 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.967 ' HA ' ' HB3' ' B' 2525 ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . 0.638 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 11.1 p-10 -72.19 -36.78 69.31 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.686 -0.688 . . . . 0.0 109.366 173.354 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . 0.967 ' HB3' ' HA ' ' B' 2522 ' ' SEP . 10.1 tp10 . . . . . 0 C--O 1.247 0.957 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.761 -177.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.612 HG11 ' HB3' ' A' 3648 ' ' ALA . 12.3 t . . . . . 0 N--CA 1.479 1.007 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . 0.48 ' OD1' HG23 ' A' 3499 ' ' VAL . 13.3 t70 -105.41 154.54 20.17 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.03 -172.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . 0.49 ' HA ' ' CD2' ' A' 3501 ' ' LEU . 72.7 mtm -67.77 -19.61 65.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.865 -176.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.48 HG23 ' OD1' ' A' 3497 ' ' ASP . 98.2 t -62.61 -23.13 31.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 CA-C-O 121.253 0.549 . . . . 0.0 111.054 178.436 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -81.63 -57.51 3.42 Favored 'General case' 0 C--N 1.319 -0.73 0 O-C-N 121.926 -0.484 . . . . 0.0 110.796 175.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.573 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp -58.32 -38.14 76.5 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -175.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.646 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -69.82 -15.81 63.17 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 118.557 0.617 . . . . 0.0 110.243 -172.363 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.602 ' N ' HD13 ' A' 3502 ' ' LEU . 28.2 mtpp -68.21 -24.73 64.97 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.2 175.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.426 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 28.4 mmtp -101.59 -42.56 6.18 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.232 176.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.744 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -144.3 99.35 4.96 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-O 121.503 0.668 . . . . 0.0 110.533 179.414 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . 0.646 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 92.6 Cg_endo -83.52 173.04 9.88 Favored 'Trans proline' 0 N--CA 1.464 -0.219 0 C-N-CA 124.128 3.219 . . . . 0.0 113.958 -174.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.497 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 82.0 mt -73.64 138.6 20.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.552 -0.749 . . . . 0.0 111.394 -177.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 23.1 m -108.58 -31.42 2.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.217 -179.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.818 ' CD1' HD12 ' A' 3524 ' ' LEU . 2.2 t-105 -138.75 148.84 44.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.391 -177.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -146.59 119.2 8.53 Favored 'General case' 0 C--N 1.312 -1.053 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 170.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . 0.471 ' O ' ' HA ' ' A' 3521 ' ' ALA . . . 177.97 -129.81 1.49 Allowed Glycine 0 N--CA 1.444 -0.817 0 N-CA-C 110.941 -0.864 . . . . 0.0 110.941 -175.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.604 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 4.9 mp -139.76 153.6 47.2 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.504 0.652 . . . . 0.0 111.931 -179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.466 HD23 ' HB2' ' A' 3547 ' ' LEU . 69.1 mt -106.15 154.12 21.13 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 167.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.673 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -142.83 121.86 12.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 117.97 0.35 . . . . 0.0 111.829 -177.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.758 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -139.34 147.09 41.08 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 172.797 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.758 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.8 OUTLIER 63.57 -99.25 0.07 Allowed 'General case' 0 N--CA 1.465 0.32 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 -170.11 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -139.39 5.79 2.28 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.934 -1.03 . . . . 0.0 108.694 176.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . . . . . . . . . 1.6 t0 -103.23 139.05 39.2 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 120.28 -0.568 . . . . 0.0 110.815 -172.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' 3514 ' ' ALA . 14.7 p -122.65 127.94 49.98 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.896 -177.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -115.74 115.51 26.46 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.602 177.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.604 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.01 112.67 6.57 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-O 121.299 0.571 . . . . 0.0 109.634 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.418 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 30.9 m -127.36 147.64 32.17 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.678 -176.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . 0.429 ' HG3' ' CE1' ' A' 3525 ' ' HIS . 20.2 pt20 -107.48 124.3 49.68 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 114.897 -1.047 . . . . 0.0 109.018 173.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.845 HD21 HD12 ' A' 3659 ' ' ILE . 4.8 mt -94.52 113.14 24.94 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.626 -176.368 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.497 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 56.5 m80 -91.03 142.6 27.6 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.688 177.717 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.744 ' O ' ' HB2' ' A' 3505 ' ' TYR . 60.0 t80 -70.02 137.31 51.24 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 172.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.571 ' CG1' HD23 ' A' 3575 ' ' LEU . 22.1 t -115.31 -55.8 4.22 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-O 121.383 0.611 . . . . 0.0 110.86 176.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.497 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 69.7 m -161.41 172.43 16.52 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.138 -171.253 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 84.51 -153.13 28.46 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.369 -0.92 . . . . 0.0 112.512 179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.545 ' HB2' ' HA ' ' A' 3571 ' ' THR . 31.1 t30 -99.46 111.23 23.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.579 0.228 . . . . 0.0 111.102 -177.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -61.83 -29.02 69.89 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.313 -178.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 98.7 t -58.79 -34.23 51.55 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.545 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.548 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 57.1 mt -59.3 -42.4 91.23 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.111 178.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -65.56 -43.52 89.59 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.916 -178.042 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 32.5 t-80 -59.1 -38.72 80.2 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.166 -178.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . . . . . . . . . 9.0 ptm85 -88.5 -18.61 27.83 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -176.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.512 ' HB2' HD11 ' A' 3626 ' ' LEU . 43.9 p -92.27 -40.24 11.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.911 0.386 . . . . 0.0 111.193 -179.223 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.629 HD13 ' HB2' ' A' 3509 ' ' TRP . 34.3 mt -79.39 120.98 82.29 Favored Pre-proline 0 C--N 1.32 -0.698 0 CA-C-O 121.108 0.48 . . . . 0.0 110.024 -174.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -73.95 -155.49 0.05 OUTLIER 'Trans proline' 0 CA--C 1.53 0.323 0 C-N-CA 123.429 2.752 . . . . 0.0 112.503 -177.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.487 ' HG ' ' HA3' ' A' 3544 ' ' GLY . 0.2 OUTLIER -107.91 148.49 29.56 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.253 176.836 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -91.24 -54.68 3.83 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.637 -178.313 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . 0.474 ' H ' ' CD ' ' A' 3542 ' ' GLU . 1.2 pm0 -86.84 110.14 19.76 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.277 0.56 . . . . 0.0 110.102 179.646 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 94.67 -5.63 69.97 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.861 -0.896 . . . . 0.0 110.861 -174.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . 0.487 ' HA3' ' HG ' ' A' 3540 ' ' LEU . . . -123.8 172.68 16.45 Favored Glycine 0 N--CA 1.444 -0.815 0 N-CA-C 111.566 -0.613 . . . . 0.0 111.566 -179.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.409 ' HA ' ' HD3' ' A' 3546 ' ' PRO . 91.7 Cg_endo -91.58 134.8 1.61 Allowed 'Trans proline' 0 N--CA 1.453 -0.898 0 C-N-CA 122.924 2.416 . . . . 0.0 112.843 177.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 36.5 Cg_exo -58.54 157.47 27.05 Favored 'Trans proline' 0 C--O 1.233 0.272 0 C-N-CA 122.817 2.344 . . . . 0.0 111.276 173.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.66 ' HB3' HD13 ' A' 3612 ' ' ILE . 36.9 mt -68.24 108.49 3.2 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.673 ' HA ' ' O ' ' A' 3514 ' ' ALA . 19.3 ptt180 -97.41 138.48 34.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.056 0.455 . . . . 0.0 111.301 -175.711 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.465 HD12 HD22 ' A' 3515 ' ' LEU . 18.9 mt -91.15 106.68 17.82 Favored 'Isoleucine or valine' 0 C--O 1.247 0.938 0 CA-C-O 122.068 0.937 . . . . 0.0 111.105 -175.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.516 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.5 -1.45 14.13 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.81 -173.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.688 ' HB2' ' HB ' ' A' 3611 ' ' ILE . 39.9 mt-30 -148.1 173.21 13.17 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.41 0.148 . . . . 0.0 110.863 177.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.608 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -150.91 140.91 22.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.004 0.431 . . . . 0.0 111.402 -179.686 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.669 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 21.7 ttt -109.53 124.93 51.92 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.089 178.257 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . 0.415 ' HG2' ' H ' ' A' 3554 ' ' ARG . 14.3 mmt180 -64.58 110.04 2.19 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 179.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.557 ' O ' HD12 ' A' 3555 ' ' LEU . 3.6 pp -79.24 97.57 6.3 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 118.559 -1.256 . . . . 0.0 108.605 176.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.552 ' O ' ' HG ' ' A' 3560 ' ' LEU . 44.9 mt-10 -118.07 164.03 15.73 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 114.471 -1.24 . . . . 0.0 109.225 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.484 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -49.99 -53.69 24.95 Favored 'General case' 0 C--N 1.326 -0.424 0 O-C-N 123.394 0.434 . . . . 0.0 111.52 -178.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 23.5 p -64.51 -39.81 94.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.482 -178.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.559 ' O ' HG23 ' A' 3563 ' ' VAL . 15.0 mm100 -66.75 -40.19 88.2 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.973 -179.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' 3556 ' ' GLU . 92.1 mt -61.19 -34.54 75.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.816 179.386 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.56 ' O ' ' HD3' ' A' 3565 ' ' ARG . 7.9 mm-40 -60.19 -49.67 76.69 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 174.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -61.58 -41.42 99.57 Favored Glycine 0 CA--C 1.519 0.316 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.702 178.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' 3559 ' ' GLN . 57.7 t -60.43 -44.77 96.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-O 120.731 0.301 . . . . 0.0 110.28 177.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . . . . . . . . . . . -57.2 -36.82 71.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.394 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.56 ' HD3' ' O ' ' A' 3561 ' ' GLU . 10.5 mpt_? -58.31 -45.15 88.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.735 -0.211 . . . . 0.0 111.506 179.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' 3563 ' ' VAL . 18.8 ptp180 -78.77 -16.34 57.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.861 0.362 . . . . 0.0 110.452 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.446 ' HG3' ' O ' ' A' 3563 ' ' VAL . 80.8 mtp -85.45 -22.01 28.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.575 0.702 . . . . 0.0 109.92 176.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 1.4 m -74.82 -23.46 58.47 Favored 'General case' 0 N--CA 1.435 -1.19 0 CA-C-N 115.058 -0.973 . . . . 0.0 110.26 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 39.7 t -98.01 87.76 1.64 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.685 -0.688 . . . . 0.0 110.358 177.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -74.23 107.72 6.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.545 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.6 m 150.57 -44.76 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.436 1.494 . . . . 0.0 107.769 -172.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -84.61 -31.1 24.45 Favored 'General case' 0 CA--C 1.509 -0.601 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.832 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.861 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -119.62 158.93 25.39 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.213 0.53 . . . . 0.0 109.777 177.395 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.602 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 42.2 t -122.4 136.87 54.98 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 170.596 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.771 HD22 HD13 ' A' 3642 ' ' LEU . 14.2 tp -104.81 125.69 51.12 Favored 'General case' 0 C--N 1.309 -1.157 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 179.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.678 HD11 HD11 ' A' 3661 ' ' ILE . 70.6 mt -126.35 154.7 43.16 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.546 -177.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.692 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -122.08 107.03 11.72 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.099 179.697 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.517 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.14 120.25 34.12 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.489 0.662 . . . . 0.0 110.356 -178.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.547 ' HG ' HD12 ' A' 3577 ' ' LEU . 57.8 mt -122.18 146.34 46.49 Favored Pre-proline 0 C--N 1.318 -0.78 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.791 -179.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.23 116.9 3.56 Favored 'Trans proline' 0 C--O 1.237 0.438 0 C-N-CA 122.145 1.897 . . . . 0.0 111.551 176.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 30.3 p -104.43 117.07 33.27 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.117 0.484 . . . . 0.0 109.97 -179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . 0.478 ' HA3' ' CG2' ' A' 3588 ' ' VAL . . . -103.42 138.59 14.08 Favored Glycine 0 N--CA 1.437 -1.271 0 C-N-CA 120.262 -0.971 . . . . 0.0 111.82 178.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . 0.488 ' HG3' ' OD2' ' A' 3587 ' ' ASP . 33.0 mtt85 -70.24 -30.46 67.53 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-O 121.706 0.765 . . . . 0.0 109.093 177.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.505 ' O ' HG23 ' A' 3588 ' ' VAL . 3.9 p30 -140.04 174.57 10.39 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.608 -1.178 . . . . 0.0 108.956 178.192 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -60.47 -40.73 92.33 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.825 0.345 . . . . 0.0 111.115 -175.109 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . 0.412 ' HB3' ' OD1' ' A' 3584 ' ' ASP . 35.0 tt0 -67.19 -44.41 79.7 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.057 0.456 . . . . 0.0 109.922 178.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.488 ' OD2' ' HG3' ' A' 3583 ' ' ARG . 5.5 t70 -55.98 -45.68 78.89 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.58 179.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' 3584 ' ' ASP . 74.1 t -55.26 -54.7 22.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.828 178.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 82.1 t -58.4 -46.75 89.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 CA-C-N 115.844 -0.617 . . . . 0.0 110.353 -178.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 46.9 t -60.54 -49.8 76.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.354 -0.839 . . . . 0.0 111.198 -179.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 22.9 mm-40 -67.36 -30.34 70.11 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.626 0.232 . . . . 0.0 111.626 -177.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 83.2 m -61.92 -48.21 81.47 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.998 0.428 . . . . 0.0 110.026 175.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 19.1 mm-40 -67.9 -46.31 71.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.25 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 19.3 m -55.45 -47.51 75.93 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.517 178.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.608 HD12 ' HB2' ' A' 3599 ' ' PHE . 65.3 tp -63.57 -41.91 98.35 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.01 0.433 . . . . 0.0 110.332 176.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.593 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 1.9 ttmt -61.18 -50.12 74.45 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.529 -0.759 . . . . 0.0 111.011 -179.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . 0.419 ' N ' ' HG2' ' A' 3596 ' ' LYS . . . -73.66 -35.78 65.27 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -179.266 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.534 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -90.49 -46.35 8.38 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -171.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.633 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 11.6 m-85 -99.58 -50.0 4.22 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.822 0.344 . . . . 0.0 111.387 -175.371 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.593 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 28.5 mm -62.12 -58.69 6.42 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.735 -176.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 59.2 m -57.75 -38.54 75.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.247 -179.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.694 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.0 OUTLIER -67.72 -53.13 29.92 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.749 0.309 . . . . 0.0 110.627 179.277 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.694 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -69.21 -34.53 75.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.486 -0.324 . . . . 0.0 111.148 -170.225 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -70.58 -36.82 73.78 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 177.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.45 -37.71 74.36 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.816 179.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' A' 3602 ' ' TYR . 72.4 mmtt -73.56 -19.51 60.87 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.703 178.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . 0.447 ' O ' ' HG ' ' A' 3555 ' ' LEU . 74.6 mt-30 48.95 50.68 17.39 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -169.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -132.92 170.67 15.0 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.898 -0.592 . . . . 0.0 112.245 -172.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.669 ' HB3' ' HB3' ' A' 3553 ' ' MET . . . -105.27 118.15 35.83 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.236 -0.893 . . . . 0.0 109.258 169.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -64.68 105.89 1.3 Allowed Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.793 -0.718 . . . . 0.0 111.336 177.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.688 ' HB ' ' HB2' ' A' 3551 ' ' GLN . 34.4 mm -90.02 122.1 41.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-O 121.22 0.533 . . . . 0.0 111.181 -174.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.66 HD13 ' HB3' ' A' 3547 ' ' LEU . 32.4 mt -120.84 117.08 51.88 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.83 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.702 175.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 14.9 m120 -95.42 126.01 40.43 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.356 -176.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . . . . . . . . . 32.1 m -123.83 147.17 52.88 Favored Pre-proline 0 C--N 1.32 -0.681 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.351 177.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.503 ' HA ' ' O ' ' A' 3621 ' ' GLN . 92.5 Cg_endo -92.12 142.05 2.48 Favored 'Trans proline' 0 N--CA 1.445 -1.344 0 C-N-CA 122.363 2.042 . . . . 0.0 112.395 173.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . . . . . . . . . 42.0 t30 -65.13 118.12 46.49 Favored Pre-proline 0 C--N 1.323 -0.561 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.854 175.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -52.74 119.03 5.34 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 123.149 2.566 . . . . 0.0 112.563 -177.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 105.02 -43.16 1.72 Allowed Glycine 0 N--CA 1.445 -0.714 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.948 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 16.4 m -88.87 -26.03 21.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.678 0.275 . . . . 0.0 110.581 -179.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 6.0 t30 63.0 39.19 10.42 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.815 0.817 . . . . 0.0 109.378 -177.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.503 ' O ' ' HA ' ' A' 3615 ' ' PRO . 8.8 tp-100 -102.0 107.56 52.97 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.246 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . . . . . . . . . 85.2 Cg_endo -78.39 24.33 0.56 Allowed 'Trans proline' 0 CA--C 1.528 0.209 0 C-N-CA 123.239 2.626 . . . . 0.0 112.779 -178.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -79.77 37.46 0.36 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.494 -177.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -128.72 132.12 47.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.136 0.493 . . . . 0.0 110.131 176.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.519 HG12 ' HG3' ' A' 3627 ' ' GLN . 2.8 t -124.23 118.01 52.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.059 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.642 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -96.28 111.3 23.41 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 171.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.53 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 76.2 mt-30 -94.18 110.94 22.64 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.953 -178.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.592 HG12 HG12 ' A' 3659 ' ' ILE . 26.3 mt -92.94 99.46 9.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.356 -179.409 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -89.01 138.08 29.34 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.001 178.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.631 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 45.0 Cg_endo -68.05 168.83 17.91 Favored 'Trans proline' 0 C--O 1.234 0.288 0 C-N-CA 122.639 2.226 . . . . 0.0 111.186 176.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -65.36 81.43 0.22 Allowed 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 122.469 2.113 . . . . 0.0 111.673 177.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . 0.542 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.9 p -113.24 162.6 15.82 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.523 -176.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 -54.89 -35.81 64.49 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.832 0.349 . . . . 0.0 110.323 176.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 40.0 t80 -53.96 -53.59 50.77 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.114 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . 0.423 ' O ' ' HG ' ' A' 3639 ' ' LEU . 49.9 p -69.92 -53.65 16.95 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.873 -177.543 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' 3632 ' ' CYS . 20.6 mm-40 -61.12 -43.86 98.23 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.857 -172.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 41.6 t -66.56 -43.49 84.88 Favored 'General case' 0 C--N 1.324 -0.502 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.118 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 12.6 m80 -64.0 -36.22 83.27 Favored 'General case' 0 C--O 1.223 -0.323 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.544 176.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' 3635 ' ' SER . 79.0 mt -64.93 -42.37 94.73 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.959 177.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.779 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 36.6 t -58.41 -35.13 71.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.267 0.556 . . . . 0.0 110.448 178.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 89.3 mtt180 -79.83 -50.24 10.8 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.823 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.771 HD13 HD22 ' A' 3575 ' ' LEU . 19.7 mt -75.31 -38.3 60.35 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.52 -0.764 . . . . 0.0 112.46 -171.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.467 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -146.54 87.56 6.4 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 120.806 0.336 . . . . 0.0 111.332 -179.429 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.66 -24.98 21.19 Favored 'Trans proline' 0 CA--C 1.531 0.363 0 C-N-CA 122.587 2.191 . . . . 0.0 113.712 -174.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 4.1 t70 -80.31 -40.28 27.1 Favored 'General case' 0 CA--C 1.513 -0.444 0 C-N-CA 120.514 -0.474 . . . . 0.0 110.534 -171.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.692 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -78.82 -29.4 44.75 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.472 -0.936 . . . . 0.0 108.472 176.559 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.779 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -54.26 -44.64 71.99 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.046 176.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . 0.612 ' HB3' HG11 ' A' 3496 ' ' VAL . . . -59.37 -34.58 72.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.903 0.382 . . . . 0.0 111.067 -179.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 18.9 m -71.15 -41.8 69.96 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.916 0.389 . . . . 0.0 110.684 177.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.579 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.2 pt -79.59 -17.58 12.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.514 -173.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 48.8 m -57.74 -26.14 61.4 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.148 0.499 . . . . 0.0 110.441 174.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -87.4 -37.39 17.08 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.141 176.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.579 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.2 tp -104.91 43.64 0.16 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 122.406 1.098 . . . . 0.0 109.198 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.476 ' N ' ' HD2' ' A' 3655 ' ' PRO . 7.7 t -37.63 -43.46 1.41 Allowed Pre-proline 0 CA--C 1.542 0.649 0 CA-C-N 114.003 -1.453 . . . . 0.0 113.22 172.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.532 ' HG2' HD12 ' A' 3653 ' ' ILE . 15.3 Cg_endo -59.16 87.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.359 1.084 0 C-N-CA 121.437 1.425 . . . . 0.0 111.601 169.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -154.83 177.95 10.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.399 -177.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.5 ' HB3' HG23 ' A' 3628 ' ' ILE . 43.5 mt -126.78 133.47 50.81 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.658 -179.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.7 tmm? -99.69 112.56 24.79 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 175.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.845 HD12 HD21 ' A' 3524 ' ' LEU . 75.8 mt -108.93 120.86 61.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-O 121.331 0.586 . . . . 0.0 111.838 -170.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.861 HG13 ' HD2' ' A' 3573 ' ' TYR . 63.7 t -103.65 116.64 47.78 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.779 -178.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.678 HD11 HD11 ' A' 3576 ' ' LEU . 57.8 mt -90.69 111.78 24.06 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 176.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.51 128.68 56.09 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.781 0.324 . . . . 0.0 111.404 -176.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 14.8 m -77.66 119.82 21.74 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.885 173.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 52.6 t . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.677 -0.677 . . . . 0.0 109.713 177.72 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.473 ' CD2' ' HB2' ' A' 3553 ' ' MET . 42.4 m-85 . . . . . 0 N--CA 1.482 1.13 0 N-CA-C 111.347 0.129 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.987 ' HG3' ' H ' ' B' 2520 ' ' THR . 6.7 tp10 58.0 -150.79 0.43 Allowed 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 177.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.987 ' H ' ' HG3' ' B' 2519 ' ' GLU . 33.7 m -154.98 126.59 7.44 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 174.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.649 ' HG ' ' N ' ' B' 2522 ' ' SEP . 36.2 tp -87.75 -128.65 0.06 Allowed 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 119.897 -0.721 . . . . 0.0 109.709 176.764 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.649 ' N ' ' HG ' ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . 0.608 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 1.0 OUTLIER -158.61 -60.84 0.08 Allowed 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.748 -176.756 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 . . . . . 0 C--O 1.244 0.769 0 CA-C-O 118.638 -0.696 . . . . 0.0 110.151 176.246 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.892 HG13 ' HB3' ' A' 3649 ' ' SER . 58.5 t . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -106.22 111.81 24.57 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.855 0.36 . . . . 0.0 111.265 -178.433 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 84.7 mtp -79.53 -33.95 41.53 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.002 -0.545 . . . . 0.0 109.879 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 41.4 t -62.9 -23.35 32.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-N 115.569 -0.741 . . . . 0.0 111.293 -178.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 32.9 mm-40 -81.76 -58.9 2.79 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 122.055 -0.403 . . . . 0.0 111.005 176.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.571 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp -64.5 -33.98 77.16 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 -173.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.626 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -67.38 -15.61 63.78 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.682 -173.929 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.626 ' N ' HD13 ' A' 3502 ' ' LEU . 23.3 ttmm -61.46 -38.42 87.17 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-O 121.063 0.459 . . . . 0.0 110.14 176.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.558 ' HD2' ' CD2' ' A' 3505 ' ' TYR . 7.5 tmtt? -94.66 -41.96 9.02 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.744 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -144.4 100.89 4.77 Favored Pre-proline 0 C--N 1.327 -0.382 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.375 -177.111 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -87.61 173.43 5.33 Favored 'Trans proline' 0 CA--C 1.531 0.356 0 C-N-CA 124.257 3.304 . . . . 0.0 113.364 -179.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.509 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 85.9 mt -71.6 128.96 35.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.719 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.472 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.0 m -98.48 -29.69 3.54 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.36 -178.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.571 ' CB ' HD13 ' A' 3538 ' ' LEU . 6.4 t-105 -153.57 158.16 40.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.21 -177.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 25.1 tt0 -150.45 119.76 6.84 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 177.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.16 -132.56 1.41 Allowed Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 120.758 -0.734 . . . . 0.0 111.276 -176.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.635 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.2 mp -139.85 153.21 46.98 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.056 0.455 . . . . 0.0 111.063 -179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.484 HD23 ' HB2' ' A' 3547 ' ' LEU . 73.7 mt -110.58 150.53 28.81 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 171.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.681 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.3 125.42 15.4 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -177.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.577 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.67 143.98 39.42 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 171.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.577 ' HD3' HD12 ' A' 3515 ' ' LEU . 0.2 OUTLIER 62.29 -94.94 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 -168.784 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 13.4 m120 -142.66 5.74 1.6 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.727 174.187 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.411 ' O ' ' HA ' ' A' 3514 ' ' ALA . 26.4 m-20 -92.96 136.18 33.49 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.964 0.412 . . . . 0.0 110.727 -175.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.525 HG22 ' HB2' ' A' 3514 ' ' ALA . 13.4 p -123.98 140.69 52.73 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.219 -177.002 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -134.41 115.65 14.25 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.12 176.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.635 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -69.7 118.63 12.8 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.212 0.529 . . . . 0.0 109.857 175.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . . . . . . . . . 27.3 m -131.07 147.55 33.02 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.76 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.82 -176.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -105.59 125.74 51.34 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.036 173.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.833 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -95.24 108.17 20.31 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-N 115.65 -0.705 . . . . 0.0 111.805 -175.797 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.509 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 71.4 m-70 -83.75 140.97 31.76 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.011 -0.995 . . . . 0.0 108.678 174.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.744 ' O ' ' HB2' ' A' 3505 ' ' TYR . 67.4 t80 -68.6 140.58 55.56 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 172.558 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.575 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.5 t -116.15 -53.06 4.58 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 121.373 0.606 . . . . 0.0 110.903 175.591 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.453 ' OG ' HD22 ' A' 3642 ' ' LEU . 39.4 t -162.38 170.81 18.19 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.268 -171.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 88.54 -147.83 20.19 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.585 -0.817 . . . . 0.0 112.885 176.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.544 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.8 t-20 -107.99 114.66 28.75 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.853 0.358 . . . . 0.0 110.845 -177.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.0 p30 -62.17 -32.37 72.98 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.811 -177.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . 0.518 ' O ' ' HG2' ' A' 3536 ' ' ARG . 45.4 t -60.06 -35.6 62.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.148 179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.494 HD23 ' HD3' ' A' 3536 ' ' ARG . 16.9 mt -55.6 -40.24 71.79 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.404 177.525 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.503 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -66.31 -44.57 83.08 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.719 -0.392 . . . . 0.0 110.452 -179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 5.2 t60 -63.82 -32.49 74.02 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.707 -0.397 . . . . 0.0 111.049 -178.496 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.518 ' HG2' ' O ' ' A' 3532 ' ' VAL . 10.8 ptm180 -88.62 -11.69 44.73 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -178.196 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.491 ' HB2' HD11 ' A' 3626 ' ' LEU . 34.2 p -103.92 -40.37 6.25 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 111.396 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.571 HD13 ' CB ' ' A' 3509 ' ' TRP . 16.7 mt -80.2 114.42 46.76 Favored Pre-proline 0 C--N 1.323 -0.574 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -176.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . 0.424 ' HB2' ' HG2' ' A' 3545 ' ' PRO . 30.3 Cg_endo -64.84 136.31 48.43 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.174 1.916 . . . . 0.0 111.871 -179.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 3.2 pp -170.96 142.39 1.85 Allowed 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.599 -177.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 12.0 t -168.7 -38.04 0.02 OUTLIER 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.092 -178.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -160.03 99.79 1.38 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.846 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 100.29 -88.48 0.77 Allowed Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.808 -0.71 . . . . 0.0 111.855 179.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . 155.68 101.14 0.18 Allowed Glycine 0 N--CA 1.446 -0.678 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.326 179.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.52 ' HA ' ' HD3' ' A' 3546 ' ' PRO . 14.3 Cg_exo -69.36 136.2 33.42 Favored 'Trans proline' 0 N--CA 1.463 -0.294 0 C-N-CA 122.956 2.437 . . . . 0.0 111.642 177.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.52 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 6.3 Cg_exo -76.59 124.78 7.83 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.445 2.097 . . . . 0.0 112.318 -179.16 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.671 ' HB3' HD13 ' A' 3612 ' ' ILE . 42.7 mt -69.32 110.93 4.9 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.015 176.399 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.681 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -96.97 138.37 34.61 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.116 0.484 . . . . 0.0 111.103 -177.541 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.5 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.3 mt -87.93 112.38 23.5 Favored 'Isoleucine or valine' 0 C--O 1.242 0.666 0 CA-C-O 121.872 0.844 . . . . 0.0 111.422 -173.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.592 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -121.47 4.9 10.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.786 -174.564 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.714 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 48.8 mt-30 -152.23 173.06 15.46 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 116.746 -0.206 . . . . 0.0 110.63 177.081 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.743 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.47 139.41 11.76 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.855 0.359 . . . . 0.0 111.654 -179.478 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.594 ' HB2' ' CD2' ' B' 2518 ' ' TYR . 13.7 tmm? -111.92 120.11 40.79 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.076 176.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 -68.55 110.01 4.01 Favored 'General case' 0 C--N 1.315 -0.927 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 -179.282 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.596 ' O ' HD12 ' A' 3555 ' ' LEU . 2.5 pp -69.77 98.38 1.2 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 122.241 1.02 . . . . 0.0 110.006 -175.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.614 ' O ' ' HG ' ' A' 3560 ' ' LEU . 38.1 mm-40 -116.83 159.16 22.78 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 114.571 -1.195 . . . . 0.0 109.535 179.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.509 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -50.19 -50.13 50.29 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.321 0.388 . . . . 0.0 111.392 -177.149 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 5.9 p -63.28 -43.91 96.56 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.646 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.481 ' O ' HG23 ' A' 3563 ' ' VAL . 16.9 mm-40 -66.28 -38.97 89.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.302 -178.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.614 ' HG ' ' O ' ' A' 3556 ' ' GLU . 87.4 mt -61.95 -35.02 77.2 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.568 179.807 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' 3557 ' ' ALA . 76.1 mm-40 -60.91 -47.17 87.63 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.072 -0.513 . . . . 0.0 109.951 174.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -59.49 -35.74 86.61 Favored Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.637 176.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.523 ' O ' ' HG3' ' A' 3567 ' ' MET . 60.2 t -67.5 -53.66 30.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.828 0.347 . . . . 0.0 110.208 176.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . 0.486 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -60.1 -26.58 66.32 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.489 -178.461 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -58.33 -40.25 81.58 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.66 179.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' 3563 ' ' VAL . 12.0 ptp180 -88.38 -14.3 38.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.927 0.394 . . . . 0.0 110.791 177.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.523 ' HG3' ' O ' ' A' 3563 ' ' VAL . 88.1 mtp -79.03 -26.61 43.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.166 -178.886 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 8.5 t -74.99 -9.09 58.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.059 0.457 . . . . 0.0 110.644 -178.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 42.3 t -115.95 91.15 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.49 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.061 178.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -70.43 108.06 4.1 Favored 'General case' 0 N--CA 1.45 -0.44 0 N-CA-C 109.317 -0.624 . . . . 0.0 109.317 178.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.544 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.0 m 153.19 -46.22 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 O-C-N 125.046 1.466 . . . . 0.0 108.089 -173.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.31 -25.94 33.51 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.929 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.684 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -128.91 162.6 27.15 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.016 177.751 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.651 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 31.1 t -126.53 135.14 50.91 Favored 'General case' 0 C--N 1.313 -1.012 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 171.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.753 HD22 HD13 ' A' 3642 ' ' LEU . 13.3 tp -105.83 125.97 51.62 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.605 HD11 HD11 ' A' 3661 ' ' ILE . 67.7 mt -126.3 155.88 41.26 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.297 0.57 . . . . 0.0 111.035 -176.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.583 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -124.24 107.06 10.8 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.226 -0.897 . . . . 0.0 108.94 -179.689 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.472 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.64 119.74 33.76 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.379 0.609 . . . . 0.0 110.346 -177.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.445 ' HG ' HD12 ' A' 3577 ' ' LEU . 74.5 mt -119.44 143.78 35.23 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.238 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.93 112.8 1.4 Allowed 'Trans proline' 0 C--O 1.233 0.243 0 C-N-CA 122.429 2.086 . . . . 0.0 111.641 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 28.5 p -101.93 113.49 26.76 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.196 0.522 . . . . 0.0 110.517 -178.46 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.85 145.43 16.12 Favored Glycine 0 N--CA 1.438 -1.175 0 C-N-CA 120.576 -0.821 . . . . 0.0 111.967 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . 0.473 ' HE ' ' CG ' ' A' 3587 ' ' ASP . 45.6 mtm180 -71.69 -34.46 69.67 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-O 121.697 0.76 . . . . 0.0 109.962 178.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.542 ' O ' HG23 ' A' 3588 ' ' VAL . 14.5 t70 -133.35 165.97 23.61 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.192 -179.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . 0.416 ' O ' HG23 ' A' 3589 ' ' VAL . 36.2 tt0 -53.82 -37.46 63.59 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.069 0.461 . . . . 0.0 110.299 176.603 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -65.99 -44.8 83.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.279 176.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.504 ' HB3' ' H ' ' A' 3584 ' ' ASP . 14.8 t70 -64.46 -41.02 96.76 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.633 -177.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' 3584 ' ' ASP . 88.7 t -56.93 -48.0 82.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.321 178.183 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' 3585 ' ' GLN . 88.9 t -59.0 -47.34 90.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.391 178.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 22.4 t -62.53 -41.59 98.97 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.828 -0.624 . . . . 0.0 111.006 -179.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . 0.613 ' NE2' ' H ' ' A' 3521 ' ' ALA . 13.1 mm100 -67.95 -38.26 82.59 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 122.318 -0.239 . . . . 0.0 110.761 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . 0.528 HG22 ' HE2' ' A' 3596 ' ' LYS . 44.9 m -62.6 -52.24 64.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.702 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' 3589 ' ' VAL . 10.6 pt-20 -62.71 -41.76 99.31 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.619 0.247 . . . . 0.0 111.146 -178.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.5 m -61.23 -46.64 89.6 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.852 0.358 . . . . 0.0 110.572 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.588 HD12 ' HB2' ' A' 3599 ' ' PHE . 50.3 tp -63.48 -42.55 98.57 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.762 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.562 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 57.7 mtmt -62.53 -45.53 92.55 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.506 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.03 -33.32 59.63 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -177.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.513 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -93.94 -46.65 7.07 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -172.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.724 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 21.4 m-85 -100.55 -50.93 3.74 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -176.214 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.562 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.0 mm -61.51 -60.9 1.96 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.276 -174.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 60.8 m -59.4 -40.59 87.13 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.3 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.724 ' HD2' ' HA ' ' A' 3599 ' ' PHE . 0.0 OUTLIER -65.04 -50.38 66.45 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.838 0.351 . . . . 0.0 110.835 -179.726 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.703 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -70.36 -36.05 73.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.911 -170.528 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -75.78 -29.17 58.68 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 116.159 -0.473 . . . . 0.0 109.942 178.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -69.31 -40.34 77.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.122 0.486 . . . . 0.0 110.175 176.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -73.46 -19.1 61.03 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.266 177.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . 0.446 ' O ' ' HG ' ' A' 3555 ' ' LEU . 46.4 mt-30 46.97 58.31 4.89 Favored 'General case' 0 C--O 1.232 0.161 0 O-C-N 123.815 0.697 . . . . 0.0 109.139 -168.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.425 ' HA ' ' O ' ' A' 3553 ' ' MET . . . -140.88 174.59 10.37 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 121.38 0.61 . . . . 0.0 112.214 -172.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.743 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -108.28 117.54 34.43 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.453 174.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -65.34 103.73 0.85 Allowed Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.046 -0.822 . . . . 0.0 111.046 176.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.714 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 29.8 mm -89.32 123.37 41.51 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 121.374 0.607 . . . . 0.0 110.902 -174.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.671 HD13 ' HB3' ' A' 3547 ' ' LEU . 48.0 mt -120.82 111.92 33.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 CA-C-N 115.076 -0.965 . . . . 0.0 109.179 174.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 6.6 m120 -88.84 136.18 33.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.555 -0.748 . . . . 0.0 109.872 -175.062 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.502 ' HB ' ' HB2' ' A' 3624 ' ' TYR . 46.1 t -116.55 122.97 31.08 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-O 120.766 0.317 . . . . 0.0 110.193 178.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.545 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 73.0 Cg_endo -100.25 141.19 0.29 Allowed 'Trans proline' 0 N--CA 1.444 -1.386 0 C-N-CA 123.333 2.689 . . . . 0.0 113.635 176.467 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.718 ' HB3' ' HB2' ' A' 3619 ' ' SER . 12.0 m120 -124.84 97.85 37.81 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 171.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -48.9 101.62 0.05 OUTLIER 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 123.516 2.81 . . . . 0.0 113.026 -174.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 80.65 -26.83 3.04 Favored Glycine 0 CA--C 1.52 0.399 0 CA-C-N 115.969 -0.56 . . . . 0.0 113.039 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . 0.718 ' HB2' ' HB3' ' A' 3616 ' ' ASN . 5.0 m -78.65 -34.91 46.02 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.741 -0.27 . . . . 0.0 111.587 -174.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' A' 3621 ' ' GLN . 5.5 t30 -160.92 -6.72 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.754 -0.378 . . . . 0.0 111.554 -178.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.845 ' HB3' ' HD2' ' A' 3622 ' ' PRO . 26.3 mp0 66.99 178.4 0.05 OUTLIER Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 116.678 -0.237 . . . . 0.0 110.412 -178.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.845 ' HD2' ' HB3' ' A' 3621 ' ' GLN . 48.5 Cg_endo -68.92 25.59 0.15 Allowed 'Trans proline' 0 C--N 1.355 0.87 0 C-N-CA 123.091 2.528 . . . . 0.0 113.592 175.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . 0.43 ' H ' ' C ' ' A' 3621 ' ' GLN . . . -75.67 35.73 0.13 Allowed 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -176.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.502 ' HB2' ' HB ' ' A' 3614 ' ' VAL . 64.6 m-85 -124.16 134.03 53.42 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 175.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.421 HG13 HD12 ' A' 3611 ' ' ILE . 2.9 t -130.68 116.65 35.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.79 175.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.6 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.6 mp -100.84 113.79 27.04 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 170.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.528 ' O ' ' HA ' ' A' 3659 ' ' ILE . 78.5 mt-30 -94.41 111.09 22.83 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.755 -0.657 . . . . 0.0 109.715 -178.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.596 HG12 HG12 ' A' 3659 ' ' ILE . 44.9 mt -92.24 98.62 8.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-O 121.024 0.44 . . . . 0.0 110.181 178.555 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . 0.437 ' CE1' ' HB2' ' A' 3609 ' ' ALA . 84.1 m-85 -89.42 141.21 28.71 Favored Pre-proline 0 C--N 1.319 -0.759 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.973 178.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.487 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 39.8 Cg_endo -67.05 172.93 9.14 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.583 2.188 . . . . 0.0 111.077 176.047 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -68.95 41.85 0.28 Allowed 'Trans proline' 0 CA--C 1.535 0.57 0 C-N-CA 122.739 2.293 . . . . 0.0 112.724 175.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . 0.502 ' O ' ' HG2' ' A' 3636 ' ' GLU . 27.0 p -77.4 162.1 27.49 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.726 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -54.9 -35.23 63.9 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.303 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 28.6 t80 -53.9 -52.33 60.87 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.004 0.43 . . . . 0.0 110.601 176.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 7.1 m -62.46 -56.64 16.25 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.654 -178.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . 0.502 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.5 mm-40 -58.3 -43.05 87.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.869 -172.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 35.6 p -62.8 -47.91 81.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.055 0.455 . . . . 0.0 110.754 -178.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 69.4 m80 -66.9 -34.76 78.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.436 179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . 0.435 HD23 HG11 ' A' 3527 ' ' VAL . 82.1 mt -63.48 -32.85 74.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.345 -0.388 . . . . 0.0 110.841 175.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.688 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 19.3 m -69.44 -33.8 73.48 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.198 0.523 . . . . 0.0 110.399 179.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 51.3 ttp180 -84.13 -34.52 24.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.337 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.753 HD13 HD22 ' A' 3575 ' ' LEU . 19.3 mt -93.73 -24.56 17.78 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 -172.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' 3647 ' ' LEU . . . -154.54 75.0 5.83 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 120.628 0.251 . . . . 0.0 111.388 178.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -64.77 -24.9 61.24 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.599 2.199 . . . . 0.0 113.417 -175.155 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 10.0 t70 -75.78 -55.15 5.91 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 -175.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.589 ' HB3' ' CE1' ' A' 3505 ' ' TYR . 0.1 OUTLIER -68.13 -30.57 69.75 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 108.574 -0.899 . . . . 0.0 108.574 179.858 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.688 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.3 tm? -53.96 -47.63 71.12 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.217 176.261 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -65.55 -19.07 65.77 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.874 0.368 . . . . 0.0 111.189 -178.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.892 ' HB3' HG13 ' A' 3496 ' ' VAL . 70.8 m -87.74 -35.35 17.96 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.872 176.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.632 ' HA ' HG22 ' A' 3653 ' ' ILE . 4.1 pt -79.94 -15.21 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.296 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.063 -178.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 49.0 m -61.92 -20.36 63.71 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.085 0.469 . . . . 0.0 110.181 175.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -88.31 -38.12 15.43 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.27 173.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.632 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -104.42 44.07 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-O 122.508 1.147 . . . . 0.0 108.853 179.715 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.467 ' N ' ' HD2' ' A' 3655 ' ' PRO . 16.1 m -32.62 -47.69 0.51 Allowed Pre-proline 0 N--CA 1.468 0.435 0 CA-C-N 113.624 -1.625 . . . . 0.0 113.174 171.122 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.497 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.7 Cg_endo -59.08 88.71 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.738 0 C-N-CA 121.605 1.537 . . . . 0.0 111.9 170.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 6.2 p-80 -154.66 169.64 23.42 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.369 -178.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.458 ' HB3' HG23 ' A' 3628 ' ' ILE . 56.9 mt -121.88 133.71 54.87 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.371 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.7 tmm? -100.38 111.65 23.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.833 HD12 HD21 ' A' 3524 ' ' LEU . 75.9 mt -106.36 120.27 57.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.59 -170.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.684 HG13 ' HD2' ' A' 3573 ' ' TYR . 87.9 t -103.76 114.83 44.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.884 -178.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.651 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 69.7 mt -91.15 120.17 39.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.059 177.659 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -116.62 126.27 53.0 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.658 0.266 . . . . 0.0 110.763 177.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 23.4 p -96.91 122.85 40.34 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.282 175.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 33.8 t . . . . . 0 C--O 1.251 1.181 0 O-C-N 123.561 0.538 . . . . 0.0 110.983 178.531 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.594 ' CD2' ' HB2' ' A' 3553 ' ' MET . 7.2 m-85 . . . . . 0 N--CA 1.481 1.086 0 N-CA-C 111.454 0.168 . . . . 0.0 111.454 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.847 ' HG2' ' H ' ' B' 2520 ' ' THR . 54.6 tt0 56.97 -150.11 0.45 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.847 ' H ' ' HG2' ' B' 2519 ' ' GLU . 5.9 t -167.32 132.34 1.99 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 175.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.736 HD12 HH11 ' A' 3552 ' ' ARG . 1.4 tp -87.16 -118.53 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 120.415 -0.514 . . . . 0.0 110.019 179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . . . . . . . . . 25.8 t70 -149.51 -65.6 0.22 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.963 172.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 3.4 mp0 . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.46 -0.781 . . . . 0.0 109.789 179.147 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.653 HG13 ' HB3' ' A' 3649 ' ' SER . 48.8 t . . . . . 0 N--CA 1.477 0.902 0 CA-C-O 121.02 0.438 . . . . 0.0 110.414 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 13.7 t70 -99.98 110.68 22.99 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 176.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 72.6 mtm -82.9 -9.98 59.04 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.148 0.499 . . . . 0.0 111.285 -177.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . . . . . . . . . 15.0 t -72.53 -21.13 19.81 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.454 -0.794 . . . . 0.0 111.094 -176.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 79.6 mt-30 -83.18 -59.07 2.59 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.879 -0.513 . . . . 0.0 111.515 176.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.552 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.8 pp -55.29 -36.56 66.29 Favored 'General case' 0 N--CA 1.464 0.234 0 N-CA-C 113.33 0.863 . . . . 0.0 113.33 -176.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.705 ' HB2' ' HA ' ' A' 3506 ' ' PRO . 0.0 OUTLIER -69.22 -15.31 63.35 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 120.068 -0.653 . . . . 0.0 110.501 -173.798 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.61 ' N ' HD13 ' A' 3502 ' ' LEU . 52.2 tptt -68.71 -24.0 64.43 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.541 176.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' 3504 ' ' LYS . 60.6 mmtt -100.32 -43.03 6.4 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.037 174.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.708 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -149.16 104.07 3.34 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.637 -179.104 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . 0.705 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 84.5 Cg_endo -84.51 173.97 8.16 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 123.988 3.125 . . . . 0.0 113.938 -174.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.414 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 86.4 mt -71.83 133.42 31.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.915 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . . . . . . . . . 26.9 m -100.94 -30.59 3.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.51 -178.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.636 ' CB ' HD13 ' A' 3538 ' ' LEU . 34.1 t-105 -150.23 149.72 30.57 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -179.045 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -143.77 119.35 10.4 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -174.48 -127.46 1.01 Allowed Glycine 0 N--CA 1.443 -0.853 0 N-CA-C 110.982 -0.847 . . . . 0.0 110.982 -177.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.629 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -138.96 158.5 44.09 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.176 0.512 . . . . 0.0 111.124 177.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.494 HD23 ' HB2' ' A' 3547 ' ' LEU . 89.7 mt -108.93 148.88 30.01 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 168.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.717 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -142.85 129.33 20.12 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 120.848 0.356 . . . . 0.0 111.182 -179.076 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.631 HD12 HD21 ' B' 2521 ' ' LEU . 0.2 OUTLIER -137.32 138.15 39.69 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 171.655 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.697 ' HE2' ' O3P' ' B' 2522 ' ' SEP . 0.1 OUTLIER 63.94 -93.96 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 -168.693 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 6.0 m120 -144.28 10.25 1.47 Allowed 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.353 173.28 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.472 ' O ' ' HA ' ' A' 3514 ' ' ALA . 8.8 m-20 -86.72 132.98 33.71 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.218 -177.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . . . . . . . . . 24.7 p -122.5 129.86 52.43 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.324 0.583 . . . . 0.0 111.945 -175.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -130.71 115.03 16.12 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.075 173.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.629 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -70.74 125.11 25.93 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.478 HG21 ' HG ' ' A' 3513 ' ' LEU . 35.0 m -130.91 149.53 33.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-O 121.585 0.707 . . . . 0.0 111.972 -174.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -113.0 124.09 51.84 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 114.732 -1.122 . . . . 0.0 108.304 170.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.796 HD21 HD12 ' A' 3659 ' ' ILE . 0.8 OUTLIER -94.01 111.21 22.9 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.636 -174.319 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.424 ' CE1' HD12 ' A' 3579 ' ' LEU . 74.4 m80 -88.72 136.34 33.05 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.981 -1.008 . . . . 0.0 108.928 177.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.708 ' O ' ' HB2' ' A' 3505 ' ' TYR . 61.0 t80 -67.6 138.31 56.33 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 173.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.566 ' CG1' HD23 ' A' 3575 ' ' LEU . 21.9 t -114.59 -56.67 4.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-O 121.243 0.544 . . . . 0.0 110.812 176.111 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.453 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 61.4 m -160.52 171.4 19.06 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.91 -171.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.19 -152.77 23.01 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 120.481 -0.866 . . . . 0.0 112.8 176.091 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.504 ' HB2' ' HA ' ' A' 3571 ' ' THR . 48.1 t-20 -91.97 111.3 22.78 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -177.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 5.0 p-10 -64.26 -33.21 75.3 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.929 0.395 . . . . 0.0 110.788 -179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . . . . . . . . . 60.6 t -62.52 -30.34 48.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.294 -179.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.564 HD23 ' HD3' ' A' 3536 ' ' ARG . 15.8 mt -59.47 -41.42 89.72 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.354 178.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . . . . . . . . . . . -68.96 -41.35 78.12 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 120.497 -0.481 . . . . 0.0 109.986 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 80.7 t60 -63.69 -33.64 76.08 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.111 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.564 ' HD3' HD23 ' A' 3533 ' ' LEU . 14.4 ptm180 -89.92 -11.73 40.94 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.225 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.47 ' O ' HG11 ' A' 3614 ' ' VAL . 47.5 p -103.7 -38.28 7.14 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.728 0.299 . . . . 0.0 111.522 -179.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.636 HD13 ' CB ' ' A' 3509 ' ' TRP . 20.3 mt -81.42 110.11 17.34 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-O 120.955 0.407 . . . . 0.0 110.005 -176.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . 0.805 ' HB2' ' HA3' ' A' 3543 ' ' GLY . 58.6 Cg_endo -76.54 156.2 36.14 Favored 'Trans proline' 0 N--CA 1.46 -0.466 0 C-N-CA 122.936 2.424 . . . . 0.0 113.03 -175.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.5 ' HB3' ' CZ3' ' A' 3509 ' ' TRP . 0.8 OUTLIER -162.42 146.28 11.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.606 -179.173 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 50.6 m 70.79 -40.72 0.48 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 123.824 0.85 . . . . 0.0 111.233 -177.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . 0.414 ' H ' ' C ' ' A' 3540 ' ' LEU . 0.4 OUTLIER -109.42 -14.93 14.34 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.647 0.737 . . . . 0.0 110.255 175.557 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . 0.805 ' HA3' ' HB2' ' A' 3539 ' ' PRO . . . -136.17 40.45 1.53 Allowed Glycine 0 N--CA 1.446 -0.658 0 CA-C-N 114.77 -1.104 . . . . 0.0 111.069 178.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . 0.66 ' N ' ' HD2' ' A' 3545 ' ' PRO . . . -62.33 -41.01 99.76 Favored Glycine 0 CA--C 1.528 0.873 0 CA-C-O 118.901 -0.944 . . . . 0.0 113.881 -179.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.66 ' HD2' ' N ' ' A' 3544 ' ' GLY . 2.3 Cg_endo -41.36 146.4 0.44 Allowed 'Trans proline' 0 C--N 1.362 1.252 0 C-N-CA 123.295 2.664 . . . . 0.0 112.692 174.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' 3545 ' ' PRO . 32.0 Cg_exo -55.78 150.0 47.48 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.754 2.303 . . . . 0.0 112.68 -175.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.718 ' HB3' HD13 ' A' 3612 ' ' ILE . 22.5 mt -67.7 113.91 5.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.63 179.12 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.717 ' HA ' ' O ' ' A' 3514 ' ' ALA . 0.0 OUTLIER -96.62 138.16 34.6 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.133 0.492 . . . . 0.0 112.028 -172.061 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.412 ' HB ' ' HB2' ' A' 3515 ' ' LEU . 19.4 mt -95.98 107.57 19.89 Favored 'Isoleucine or valine' 0 C--O 1.245 0.841 0 CA-C-O 122.236 1.017 . . . . 0.0 111.694 -172.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.439 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -113.93 -2.61 13.54 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.054 -173.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.665 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 69.4 mt-30 -146.81 176.72 9.66 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.359 0.123 . . . . 0.0 110.872 177.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.8 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -159.45 140.58 12.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.952 0.406 . . . . 0.0 111.604 179.285 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.585 ' HB2' ' CD2' ' B' 2518 ' ' TYR . 14.8 tmm? -109.71 122.8 48.3 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.174 178.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' 3554 ' ' ARG . 8.5 mmm180 -69.88 110.07 4.8 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 109.549 -0.538 . . . . 0.0 109.549 -177.081 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.517 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -73.52 98.3 2.77 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.281 1.039 . . . . 0.0 109.524 -177.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.616 ' O ' ' HG ' ' A' 3560 ' ' LEU . 34.2 mt-10 -111.49 171.67 7.34 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 114.401 -1.272 . . . . 0.0 109.67 179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.418 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -57.54 -51.34 69.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.843 0.354 . . . . 0.0 111.041 -179.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 36.1 p -65.91 -32.81 74.53 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.387 -179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.583 ' O ' HG23 ' A' 3563 ' ' VAL . 18.9 mm-40 -71.53 -40.54 70.02 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.093 179.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.616 ' HG ' ' O ' ' A' 3556 ' ' GLU . 84.8 mt -60.06 -34.27 73.2 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 121.019 0.437 . . . . 0.0 110.109 177.721 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' 3557 ' ' ALA . 17.5 mm-40 -60.9 -49.74 76.24 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.119 173.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -65.02 -30.2 77.37 Favored Glycine 0 CA--C 1.52 0.347 0 CA-C-N 115.673 -0.694 . . . . 0.0 112.771 -179.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.596 ' O ' ' HG3' ' A' 3567 ' ' MET . 59.8 t -66.71 -53.87 30.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 174.917 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . 0.401 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.22 -31.06 68.71 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.594 178.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 -53.08 -51.82 60.58 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.691 176.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . 0.447 HH11 ' HD3' ' A' 3566 ' ' ARG . 14.0 ptt-85 -83.04 -9.28 59.33 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.093 0.473 . . . . 0.0 111.046 -178.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.596 ' HG3' ' O ' ' A' 3563 ' ' VAL . 81.2 mtp -84.5 -22.72 30.12 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.812 178.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . . . . . . . . . 43.5 p -77.42 -5.73 50.85 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.035 0.445 . . . . 0.0 110.988 178.46 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 20.5 t -119.34 78.7 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.798 175.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -65.0 108.85 1.93 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.045 -0.525 . . . . 0.0 109.66 176.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.504 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 1.8 m 153.05 -41.73 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.639 0 O-C-N 124.921 1.388 . . . . 0.0 108.346 -176.117 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -84.96 -26.23 27.3 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.641 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.685 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -124.93 164.81 19.29 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.757 177.834 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.673 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 33.7 t -127.49 136.61 52.0 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 172.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.715 HD22 HD13 ' A' 3642 ' ' LEU . 13.0 tp -105.73 125.12 50.61 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.647 HD11 HD11 ' A' 3661 ' ' ILE . 67.7 mt -126.85 155.24 43.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.115 0.483 . . . . 0.0 111.035 -177.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.71 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.3 OUTLIER -123.79 107.19 11.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.203 179.257 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.474 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.35 122.61 37.09 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.527 0.679 . . . . 0.0 110.488 -178.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.504 HD21 HG22 ' A' 3650 ' ' ILE . 68.8 mt -122.88 147.58 51.53 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.658 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . 0.466 ' HA ' ' O ' ' A' 3521 ' ' ALA . 13.8 Cg_endo -57.42 125.47 18.93 Favored 'Trans proline' 0 CA--C 1.531 0.35 0 C-N-CA 122.096 1.864 . . . . 0.0 111.829 176.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 29.8 p -107.61 119.19 38.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.308 0.575 . . . . 0.0 110.164 178.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -104.49 146.08 16.13 Favored Glycine 0 N--CA 1.443 -0.899 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.769 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . 0.432 ' HG3' ' OD2' ' A' 3587 ' ' ASP . 35.6 mtp180 -69.97 -20.53 63.3 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.7 0.762 . . . . 0.0 108.946 173.92 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.599 ' O ' HG23 ' A' 3588 ' ' VAL . 9.7 t70 -154.26 169.55 23.39 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.553 -1.203 . . . . 0.0 107.876 -178.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -56.69 -44.69 81.74 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 118.165 0.439 . . . . 0.0 110.905 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -63.72 -35.51 80.8 Favored 'General case' 0 N--CA 1.446 -0.648 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.484 179.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.457 ' HB3' ' H ' ' A' 3584 ' ' ASP . 20.3 t70 -68.02 -40.72 82.9 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.194 -178.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.599 HG23 ' O ' ' A' 3584 ' ' ASP . 73.9 t -56.12 -45.15 80.58 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.511 177.023 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . . . . . . . . . 85.6 t -55.78 -46.96 80.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.786 177.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 28.7 t -65.28 -43.79 90.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.026 -178.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -64.24 -37.28 86.91 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.49 179.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 90.1 m -60.95 -54.96 38.59 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.612 177.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -65.54 -36.0 82.52 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.276 -177.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 20.9 t -65.32 -44.42 87.86 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 177.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.511 HD12 ' HB2' ' A' 3599 ' ' PHE . 58.7 tp -64.66 -45.96 84.53 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.119 -178.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.795 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.0 OUTLIER -65.62 -29.3 69.87 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.324 -176.42 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -85.6 -41.05 15.59 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.245 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . . . . . . . . . . . -86.87 -46.36 9.99 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.675 0.62 . . . . 0.0 112.675 -171.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.511 ' HB2' HD12 ' A' 3595 ' ' LEU . 11.2 m-85 -98.91 -50.74 4.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.806 0.336 . . . . 0.0 111.212 -175.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.795 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 24.8 mm -59.8 -54.55 33.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 115.707 -0.678 . . . . 0.0 110.978 -176.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . 0.463 ' O ' ' HG3' ' A' 3604 ' ' GLN . 59.2 m -62.42 -38.4 89.53 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.431 -178.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . . . . . . . . . 43.0 t80 -72.05 -54.32 10.2 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.116 -178.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.532 HD12 ' O ' ' A' 3608 ' ' ALA . 0.4 OUTLIER -57.01 -38.78 73.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.794 179.85 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . 0.463 ' HG3' ' O ' ' A' 3601 ' ' THR . 0.0 OUTLIER -72.29 -34.64 68.32 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.149 -179.819 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -64.86 -36.98 86.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.874 178.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 70.0 mmtt -84.1 -18.14 37.84 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.119 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . . . . . . . . . 77.3 mt-30 51.21 55.38 9.58 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 -169.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.552 ' HB1' ' HB2' ' A' 3552 ' ' ARG . . . -135.21 -177.63 4.73 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.256 0.551 . . . . 0.0 112.113 -173.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.8 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.65 117.46 28.36 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.672 175.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -62.81 104.48 0.8 Allowed Glycine 0 C--O 1.224 -0.517 0 C-N-CA 120.751 -0.738 . . . . 0.0 111.365 178.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.665 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 36.5 mm -89.86 124.01 42.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-O 121.322 0.582 . . . . 0.0 110.884 -174.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.718 HD13 ' HB3' ' A' 3547 ' ' LEU . 45.7 mt -119.78 108.66 24.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.607 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.412 ' HA ' ' O ' ' A' 3624 ' ' TYR . 87.2 m-20 -85.22 121.17 27.58 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.67 -176.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.47 HG11 ' O ' ' A' 3537 ' ' SER . 48.4 t -105.88 124.96 34.4 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.983 -178.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.627 ' HA ' ' O ' ' A' 3621 ' ' GLN . 93.9 Cg_endo -90.99 138.22 2.34 Favored 'Trans proline' 0 N--CA 1.448 -1.169 0 C-N-CA 122.687 2.258 . . . . 0.0 112.053 171.565 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.552 ' HB2' ' HB2' ' A' 3619 ' ' SER . 20.7 m120 -67.73 127.49 93.38 Favored Pre-proline 0 C--N 1.322 -0.623 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.035 178.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -52.05 114.9 1.83 Allowed 'Trans proline' 0 C--N 1.343 0.243 0 C-N-CA 123.107 2.538 . . . . 0.0 112.432 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 96.63 -40.8 2.49 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.165 179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . 0.552 ' HB2' ' HB2' ' A' 3616 ' ' ASN . 44.3 m -81.55 -29.42 33.49 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.67 0.271 . . . . 0.0 110.935 -179.584 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . 0.465 ' O ' ' HD3' ' A' 3622 ' ' PRO . 3.9 m-20 61.72 28.19 17.35 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.673 -179.159 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.627 ' O ' ' HA ' ' A' 3615 ' ' PRO . 25.9 tp60 -89.46 106.81 15.01 Favored Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.059 178.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.491 ' HD2' HE21 ' A' 3621 ' ' GLN . 87.5 Cg_endo -80.5 26.6 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 123.436 2.757 . . . . 0.0 112.802 -178.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -75.76 34.93 0.12 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -175.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.54 ' HE2' HD21 ' A' 3616 ' ' ASN . 60.0 m-85 -128.49 133.95 48.6 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-O 120.959 0.409 . . . . 0.0 110.487 174.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.497 HG13 HD12 ' A' 3611 ' ' ILE . 4.1 t -126.05 113.89 36.24 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.095 177.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.4 mp -98.84 112.46 24.55 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.479 ' O ' ' HA ' ' A' 3659 ' ' ILE . 33.9 mt-30 -95.14 111.15 23.01 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.9 -176.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.574 HG12 HG12 ' A' 3659 ' ' ILE . 39.9 mt -93.12 99.12 9.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.628 -179.1 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -89.71 145.21 33.04 Favored Pre-proline 0 C--N 1.32 -0.68 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.005 178.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . . . . . . . . . 48.0 Cg_endo -69.32 169.37 18.5 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.427 2.085 . . . . 0.0 111.243 173.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . 0.425 ' HD3' HD12 ' A' 3600 ' ' ILE . 57.0 Cg_endo -71.08 48.23 0.85 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 123.185 2.59 . . . . 0.0 112.576 178.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . . . . . . . . . 13.9 p -74.72 163.4 27.73 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.182 -0.917 . . . . 0.0 110.374 179.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -47.43 -47.56 26.8 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.71 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 30.1 t80 -47.06 -48.11 22.52 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.414 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 20.6 t -59.26 -58.8 7.06 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.978 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -66.76 -35.22 79.59 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.336 -171.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 62.0 m -58.18 -57.77 11.39 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 120.867 0.365 . . . . 0.0 110.725 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . 0.491 ' CE1' HD11 ' A' 3575 ' ' LEU . 10.2 p80 -69.42 -26.14 64.47 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 120.145 -0.622 . . . . 0.0 110.721 -177.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 50.2 mt -64.42 -35.27 80.38 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.843 0.354 . . . . 0.0 110.375 177.11 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.948 ' HA ' HD22 ' A' 3647 ' ' LEU . 16.6 m -67.78 -39.01 84.14 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.232 179.172 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 18.5 tpp180 -78.18 -24.06 47.34 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.491 -177.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.715 HD13 HD22 ' A' 3575 ' ' LEU . 17.4 mt -101.13 -41.0 6.91 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -172.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.514 ' HB1' ' CZ ' ' A' 3505 ' ' TYR . . . -147.09 89.11 5.67 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 120.751 0.31 . . . . 0.0 111.687 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . 0.434 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 85.6 Cg_endo -78.14 -16.78 13.82 Favored 'Trans proline' 0 CA--C 1.534 0.475 0 C-N-CA 122.608 2.205 . . . . 0.0 113.974 -175.034 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . . . . . . . . . 6.8 t0 -76.08 -53.4 8.39 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -177.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.71 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -73.13 -28.02 62.01 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 179.82 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.948 HD22 ' HA ' ' A' 3640 ' ' SER . 24.3 tp -52.15 -52.88 49.08 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.061 0.458 . . . . 0.0 111.04 175.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -63.23 -17.95 63.01 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.254 -177.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.653 ' HB3' HG13 ' A' 3496 ' ' VAL . 11.0 m -87.39 -37.34 17.14 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.474 178.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.602 ' HA ' HG22 ' A' 3653 ' ' ILE . 3.5 pt -79.4 -12.13 13.15 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.229 0 CA-C-O 120.863 0.363 . . . . 0.0 111.392 -178.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 19.7 m -55.05 -37.97 67.4 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.485 177.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 8.8 t30 -80.16 -33.5 38.38 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.841 0.353 . . . . 0.0 110.743 178.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.602 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.6 tp -104.01 39.67 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 122.585 1.184 . . . . 0.0 109.279 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.439 ' N ' ' HD2' ' A' 3655 ' ' PRO . 47.0 t -33.92 -46.03 0.63 Allowed Pre-proline 0 CA--C 1.541 0.604 0 CA-C-N 113.582 -1.644 . . . . 0.0 113.286 169.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.463 ' HG2' HD12 ' A' 3653 ' ' ILE . 19.8 Cg_endo -61.17 79.84 0.08 OUTLIER 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 121.519 1.479 . . . . 0.0 111.776 170.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . 0.404 ' HB2' HD23 ' A' 3579 ' ' LEU . 31.5 p80 -143.78 170.31 16.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.782 -0.645 . . . . 0.0 109.999 -178.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.471 HD22 HG22 ' A' 3628 ' ' ILE . 69.2 mt -115.38 143.38 45.37 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.526 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 8.7 tmm? -110.48 111.26 22.39 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 177.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.796 HD12 HD21 ' A' 3524 ' ' LEU . 70.3 mt -107.95 122.52 62.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.652 -170.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.685 HG13 ' HD2' ' A' 3573 ' ' TYR . 72.3 t -106.27 116.47 50.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.005 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.673 ' HB ' ' HB3' ' A' 3574 ' ' CYS . 54.0 mt -91.0 113.12 26.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 109.816 -0.438 . . . . 0.0 109.816 177.213 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -111.81 128.92 56.26 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.107 -179.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 13.7 m -76.14 132.12 39.81 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.271 -0.422 . . . . 0.0 109.955 174.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 47.7 t . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.441 -0.79 . . . . 0.0 109.696 175.677 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.585 ' CD2' ' HB2' ' A' 3553 ' ' MET . 13.2 m-85 . . . . . 0 N--CA 1.482 1.132 0 CA-C-O 120.36 0.124 . . . . 0.0 111.238 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.682 ' HG2' ' H ' ' B' 2520 ' ' THR . 14.5 tt0 55.09 -157.28 0.22 Allowed 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.765 -0.457 . . . . 0.0 109.765 177.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.682 ' H ' ' HG2' ' B' 2519 ' ' GLU . 85.3 m -155.53 121.26 5.01 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 174.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.71 HD12 ' HD2' ' A' 3552 ' ' ARG . 0.5 OUTLIER -79.58 -120.37 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.155 -0.618 . . . . 0.0 109.713 -179.414 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.697 ' O3P' ' HE2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . 0.408 ' CG ' ' HB2' ' A' 3548 ' ' ARG . 8.6 t70 -149.94 -158.45 0.92 Allowed 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 -178.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 30.3 tt0 . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.318 -0.848 . . . . 0.0 109.814 179.023 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . 0.414 ' HB ' ' OG ' ' A' 3649 ' ' SER . 30.6 m . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 120.778 0.323 . . . . 0.0 110.339 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 16.9 t70 -105.56 112.84 26.09 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.082 0.468 . . . . 0.0 110.523 -179.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 4.6 mpp? -81.9 -20.57 38.5 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.623 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.492 ' HA ' HD12 ' A' 3502 ' ' LEU . 34.6 t -62.62 -24.66 36.03 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.043 -177.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -74.97 -59.41 2.75 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.072 0.463 . . . . 0.0 110.865 173.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.567 HD13 ' HB2' ' A' 3646 ' ' LEU . 3.1 pp -69.42 -32.51 71.53 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -169.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.614 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -70.17 -15.68 62.98 Favored 'General case' 0 N--CA 1.463 0.184 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.239 -173.852 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.614 ' N ' HD13 ' A' 3502 ' ' LEU . 49.6 tptt -67.05 -30.58 70.69 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 177.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 17.1 tptm -96.37 -39.68 9.49 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.399 178.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.688 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -151.4 106.97 2.94 Favored Pre-proline 0 CA--C 1.537 0.477 0 CA-C-O 121.454 0.645 . . . . 0.0 111.148 178.756 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . 0.546 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 97.5 Cg_endo -86.35 174.41 6.05 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 124.184 3.256 . . . . 0.0 113.937 -177.747 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.507 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 94.4 mt -71.4 135.41 28.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.259 -178.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.521 HG13 ' HB2' ' A' 3526 ' ' PHE . 31.4 m -102.46 -29.9 3.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.325 179.821 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.65 ' HB2' HD13 ' A' 3538 ' ' LEU . 39.9 t-105 -150.07 154.66 38.5 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.286 -178.32 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 28.5 tt0 -150.52 119.14 6.51 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 176.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -170.3 -125.06 0.78 Allowed Glycine 0 N--CA 1.443 -0.881 0 N-CA-C 111.226 -0.75 . . . . 0.0 111.226 -176.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.655 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.5 mp -141.44 158.57 43.68 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.087 0.47 . . . . 0.0 111.178 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.476 ' CD2' ' HB2' ' A' 3547 ' ' LEU . 81.8 mt -113.24 150.25 32.64 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 169.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.591 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -145.21 125.62 13.97 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -177.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.596 HD12 HD21 ' B' 2521 ' ' LEU . 0.2 OUTLIER -138.39 138.71 38.5 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 171.944 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.576 ' HD2' ' HB3' ' B' 2522 ' ' SEP . 0.3 OUTLIER 59.97 -96.31 0.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.537 0.523 . . . . 0.0 110.122 -170.644 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -138.06 9.33 2.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.579 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.41 ' O ' ' HA ' ' A' 3514 ' ' ALA . 27.5 m-20 -100.28 125.71 46.51 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.857 -177.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.511 HG22 ' HB2' ' A' 3514 ' ' ALA . 38.6 p -117.73 134.83 54.5 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.563 177.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -129.86 122.51 28.81 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 176.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.655 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -73.67 119.42 17.87 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.076 0.465 . . . . 0.0 110.133 178.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.428 ' CG2' ' HG ' ' A' 3513 ' ' LEU . 35.0 m -130.44 147.98 33.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-O 121.596 0.712 . . . . 0.0 112.061 -175.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -108.89 126.02 52.62 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.043 172.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.825 HD21 HD12 ' A' 3659 ' ' ILE . 1.2 mt -94.83 110.31 22.19 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.736 -176.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.507 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 79.2 m-70 -86.71 138.96 31.21 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.03 -0.986 . . . . 0.0 108.878 176.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.688 ' O ' ' HB2' ' A' 3505 ' ' TYR . 69.1 t80 -68.99 137.91 54.1 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 173.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.584 ' CG1' HD23 ' A' 3575 ' ' LEU . 23.3 t -114.61 -56.51 4.11 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.933 0 CA-C-O 121.474 0.654 . . . . 0.0 110.664 176.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.439 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 73.8 m -160.83 171.84 18.06 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.376 -0.829 . . . . 0.0 109.997 -172.081 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 90.12 -150.95 21.25 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.511 -0.852 . . . . 0.0 112.897 176.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.549 ' HB2' ' HA ' ' A' 3571 ' ' THR . 28.7 t-20 -101.53 111.73 24.06 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.955 0.407 . . . . 0.0 111.099 -177.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 9.2 p30 -62.31 -30.67 71.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.482 -177.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . 0.565 ' O ' ' HG2' ' A' 3536 ' ' ARG . 62.1 t -61.08 -35.57 66.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.491 -179.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.434 ' HB2' ' HB2' ' A' 3574 ' ' CYS . 29.7 mt -55.98 -40.45 73.31 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.929 177.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.405 ' HB1' ' CD1' ' A' 3538 ' ' LEU . . . -70.19 -37.14 75.04 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.994 0.426 . . . . 0.0 110.693 -179.504 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 52.2 t-80 -61.5 -39.34 90.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.892 179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.565 ' HG2' ' O ' ' A' 3532 ' ' VAL . 12.5 ptp180 -88.7 -21.39 23.91 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -177.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.527 ' HB2' HD11 ' A' 3626 ' ' LEU . 58.0 p -90.17 -43.31 10.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.71 0.291 . . . . 0.0 111.508 -178.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.65 HD13 ' HB2' ' A' 3509 ' ' TRP . 25.2 mt -78.65 113.59 36.14 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 -174.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -78.18 146.51 22.64 Favored 'Trans proline' 0 N--CA 1.461 -0.392 0 C-N-CA 123.174 2.583 . . . . 0.0 113.258 -170.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . . . . . . . . . 1.5 pt? -165.37 169.53 15.64 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.061 -179.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 23.0 t 175.26 -42.86 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 -178.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -151.74 136.68 17.26 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.642 175.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 63.56 -108.36 2.17 Favored Glycine 0 N--CA 1.448 -0.5 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.515 -178.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -175.45 97.19 0.11 Allowed Glycine 0 N--CA 1.446 -0.657 0 N-CA-C 111.445 -0.662 . . . . 0.0 111.445 179.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -61.94 146.44 96.36 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 123.295 2.663 . . . . 0.0 112.723 -177.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.638 ' HA ' ' O ' ' A' 3512 ' ' LEU . 93.2 Cg_endo -84.23 126.48 3.74 Favored 'Trans proline' 0 N--CA 1.451 -0.974 0 C-N-CA 122.676 2.251 . . . . 0.0 112.232 177.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.676 ' HB3' HD13 ' A' 3612 ' ' ILE . 28.6 mt -69.24 113.22 6.39 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.164 -0.471 . . . . 0.0 109.795 175.509 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.635 ' HD2' ' OD2' ' B' 2523 ' ' ASP . 40.4 ptt85 -91.41 135.76 33.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.936 0.398 . . . . 0.0 110.842 -175.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.677 ' CG2' HD22 ' B' 2521 ' ' LEU . 19.2 mt -91.61 107.87 19.31 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-O 122.211 1.005 . . . . 0.0 111.021 -177.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.478 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -115.21 2.32 14.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.179 -0.918 . . . . 0.0 111.562 -175.012 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.698 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 73.9 mt-30 -151.54 171.94 16.79 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.581 0.229 . . . . 0.0 110.98 178.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.696 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -154.28 138.34 16.43 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.013 0.435 . . . . 0.0 111.322 -179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.718 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 17.9 ttt -109.49 124.88 51.81 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.467 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -65.75 110.79 2.94 Favored 'General case' 0 C--N 1.315 -0.907 0 C-N-CA 120.66 -0.416 . . . . 0.0 110.37 178.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.57 ' O ' HD12 ' A' 3555 ' ' LEU . 2.8 pp -75.13 97.95 3.58 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 122.32 1.057 . . . . 0.0 108.965 178.101 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.664 ' HB2' ' HG2' ' A' 3559 ' ' GLN . 58.2 mm-40 -113.18 165.43 12.41 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.555 -1.202 . . . . 0.0 109.821 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.498 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -55.31 -51.87 65.31 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.319 0.387 . . . . 0.0 111.098 -179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 41.5 p -62.09 -33.15 73.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.073 0.463 . . . . 0.0 110.908 179.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.664 ' HG2' ' HB2' ' A' 3556 ' ' GLU . 32.1 mm-40 -73.88 -44.43 55.35 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.047 -176.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.542 HD21 ' HB2' ' A' 3555 ' ' LEU . 83.0 mt -64.11 -32.56 74.17 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.55 -0.296 . . . . 0.0 111.254 -176.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' 3557 ' ' ALA . 8.0 mm-40 -69.23 -44.02 72.84 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 174.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . 0.417 ' O ' ' HB3' ' A' 3565 ' ' ARG . . . -59.49 -40.03 95.7 Favored Glycine 0 CA--C 1.52 0.357 0 CA-C-N 115.44 -0.8 . . . . 0.0 112.312 176.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.563 HG23 ' O ' ' A' 3559 ' ' GLN . 62.7 t -62.51 -48.02 90.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 110.006 -0.368 . . . . 0.0 110.006 175.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . 0.538 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -59.44 -32.3 70.08 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.113 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.503 ' O ' HG22 ' A' 3568 ' ' THR . 43.4 ttm180 -57.82 -46.26 84.96 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.81 177.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . . . . . . . . . 20.0 ptt180 -87.05 -5.32 59.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.936 0.398 . . . . 0.0 111.297 178.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.538 ' HB2' ' HA ' ' A' 3564 ' ' ALA . 82.5 mtp -88.65 -21.12 24.13 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.959 176.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . 0.503 HG22 ' O ' ' A' 3565 ' ' ARG . 3.3 t -74.59 -14.34 60.77 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.84 0.352 . . . . 0.0 111.186 -174.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 99.2 t -114.4 101.98 13.2 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-O 121.113 0.482 . . . . 0.0 110.412 178.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -73.99 108.32 6.73 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.549 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.5 m 151.47 -39.96 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 125.45 1.5 . . . . 0.0 108.082 -174.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -82.46 -26.37 32.71 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.523 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.732 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.2 OUTLIER -135.36 169.06 18.08 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.294 179.061 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.62 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 34.5 t -130.1 136.56 49.46 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 171.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.781 HD22 HD13 ' A' 3642 ' ' LEU . 13.1 tp -106.54 125.98 51.69 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 109.3 -0.63 . . . . 0.0 109.3 179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.667 HD11 HD11 ' A' 3661 ' ' ILE . 79.5 mt -127.53 157.05 41.17 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.175 0.512 . . . . 0.0 111.022 -177.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.616 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -124.03 109.43 13.51 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.173 179.079 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.472 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -95.1 123.36 38.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.277 0.561 . . . . 0.0 110.584 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.452 ' HG ' HD12 ' A' 3577 ' ' LEU . 69.0 mt -124.02 144.83 46.25 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-N 114.988 -1.005 . . . . 0.0 110.09 -179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.83 112.51 1.66 Allowed 'Trans proline' 0 CA--C 1.53 0.321 0 C-N-CA 122.402 2.068 . . . . 0.0 111.955 178.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 27.9 p -96.74 108.31 20.93 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.222 0.534 . . . . 0.0 110.657 -177.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . . . . . . . . . . . -103.06 146.79 16.67 Favored Glycine 0 N--CA 1.442 -0.93 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.059 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . 0.402 ' HG2' ' H ' ' A' 3583 ' ' ARG . 13.5 mmt180 -68.31 -36.68 79.68 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.682 0.753 . . . . 0.0 109.46 179.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.639 ' O ' HG23 ' A' 3588 ' ' VAL . 17.1 t70 -129.72 164.71 23.4 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.311 -179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . 0.44 ' O ' HG23 ' A' 3589 ' ' VAL . 23.7 tp60 -56.61 -39.39 73.51 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.887 0.375 . . . . 0.0 110.374 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -64.58 -44.89 89.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.144 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.49 ' HB3' ' H ' ' A' 3584 ' ' ASP . 30.0 t70 -60.59 -43.16 97.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.308 178.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.639 HG23 ' O ' ' A' 3584 ' ' ASP . 98.4 t -56.04 -47.99 79.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.215 177.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' 3585 ' ' GLN . 80.4 t -60.06 -47.23 92.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.293 178.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 42.3 t -60.73 -42.06 96.58 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.061 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -69.55 -36.06 76.0 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 121.001 -0.279 . . . . 0.0 110.661 177.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 85.6 m -62.25 -53.17 58.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.697 178.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' 3596 ' ' LYS . 11.9 pt-20 -63.57 -34.15 77.17 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.628 -0.26 . . . . 0.0 111.18 -178.654 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 49.6 m -69.35 -46.12 67.77 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.884 0.374 . . . . 0.0 110.259 177.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.592 HD12 ' HB2' ' A' 3599 ' ' PHE . 63.9 tp -64.36 -43.55 94.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.958 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.811 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 0.1 OUTLIER -66.3 -32.87 74.54 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.958 -177.002 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -83.56 -37.58 22.79 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.795 0.331 . . . . 0.0 111.404 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.565 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -88.95 -45.91 9.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -172.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.72 ' HA ' ' HD2' ' A' 3602 ' ' TYR . 19.7 m-85 -99.73 -50.08 4.16 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.671 0.272 . . . . 0.0 111.542 -176.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.811 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 24.0 mm -62.04 -60.28 2.98 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.131 -175.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 91.2 m -56.96 -42.44 80.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.147 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.72 ' HD2' ' HA ' ' A' 3599 ' ' PHE . 0.0 OUTLIER -63.52 -53.37 52.99 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.542 0.211 . . . . 0.0 110.826 179.479 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.709 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.0 OUTLIER -66.73 -36.22 81.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.916 0.389 . . . . 0.0 110.916 -170.916 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -73.87 -36.35 64.82 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.075 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -71.46 -34.56 70.32 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.786 0.327 . . . . 0.0 110.911 179.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . 0.586 ' HG2' ' O ' ' A' 3602 ' ' TYR . 66.5 mmtt -73.92 -18.17 60.93 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.488 177.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . 0.501 ' O ' ' HG ' ' A' 3555 ' ' LEU . 21.1 mt-30 55.05 43.61 29.44 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.352 -0.61 . . . . 0.0 109.352 -172.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.578 ' HB1' ' HB2' ' A' 3552 ' ' ARG . . . -132.62 172.06 13.02 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.861 -0.609 . . . . 0.0 112.541 -170.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.718 ' HB3' ' HB3' ' A' 3553 ' ' MET . . . -107.95 118.67 37.35 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.048 -0.978 . . . . 0.0 109.354 172.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -63.01 103.6 0.67 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.528 -0.844 . . . . 0.0 111.211 177.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.698 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 32.7 mm -90.01 126.69 42.87 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-O 121.188 0.518 . . . . 0.0 110.924 -175.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.676 HD13 ' HB3' ' A' 3547 ' ' LEU . 39.7 mt -125.94 115.07 41.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.882 177.069 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . 0.435 ' HA ' ' O ' ' A' 3624 ' ' TYR . 6.9 m120 -90.09 119.75 30.69 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.0 179.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.584 ' O ' ' HA ' ' A' 3622 ' ' PRO . 30.2 m -115.54 143.1 29.89 Favored Pre-proline 0 C--N 1.316 -0.859 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.863 -178.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.577 ' HA ' ' HA ' ' A' 3622 ' ' PRO . 93.2 Cg_endo -91.72 137.12 1.87 Allowed 'Trans proline' 0 N--CA 1.445 -1.378 0 C-N-CA 122.452 2.101 . . . . 0.0 112.48 174.402 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.43 ' OD1' ' HB2' ' A' 3619 ' ' SER . 3.8 t-20 -95.15 106.25 24.56 Favored Pre-proline 0 C--N 1.315 -0.903 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 176.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -31.41 88.84 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.887 0 C-N-CA 125.16 3.907 . . . . 0.0 115.083 -168.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 52.74 18.25 5.45 Favored Glycine 0 C--N 1.335 0.522 0 CA-C-N 115.411 -0.813 . . . . 0.0 114.126 177.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . 0.43 ' HB2' ' OD1' ' A' 3616 ' ' ASN . 18.8 m -108.13 -35.86 6.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 117.315 0.558 . . . . 0.0 112.282 -175.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 63.7 t30 -153.36 13.82 0.5 Allowed 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.141 -0.623 . . . . 0.0 111.827 -174.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.77 ' HB3' ' HD2' ' A' 3622 ' ' PRO . 2.3 mp0 68.1 175.02 0.08 OUTLIER Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.822 174.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.77 ' HD2' ' HB3' ' A' 3621 ' ' GLN . 61.3 Cg_endo -73.96 25.46 0.33 Allowed 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 123.41 2.74 . . . . 0.0 113.921 175.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -76.51 43.73 0.33 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.957 0.408 . . . . 0.0 111.558 -178.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.512 ' OH ' ' HD3' ' A' 3536 ' ' ARG . 78.9 m-85 -128.63 132.83 48.15 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-O 121.031 0.443 . . . . 0.0 110.587 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.455 HG12 ' HG3' ' A' 3627 ' ' GLN . 5.7 t -119.37 114.7 45.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.99 178.501 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.625 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.7 mp -96.27 110.93 23.15 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 170.307 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.478 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 18.3 mt-30 -94.44 110.43 22.22 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 115.889 -0.596 . . . . 0.0 109.826 -178.145 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.578 HG12 HG12 ' A' 3659 ' ' ILE . 35.6 mt -92.14 99.27 9.44 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.889 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 -179.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.97 141.6 29.68 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.038 178.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.414 ' HD3' ' HG ' ' A' 3603 ' ' LEU . 40.6 Cg_endo -67.33 165.39 27.07 Favored 'Trans proline' 0 CA--C 1.53 0.309 0 C-N-CA 122.591 2.194 . . . . 0.0 111.233 175.193 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -69.28 77.93 0.87 Allowed 'Trans proline' 0 C--N 1.347 0.467 0 C-N-CA 122.535 2.157 . . . . 0.0 111.876 178.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . 0.435 ' O ' ' HG2' ' A' 3636 ' ' GLU . 6.5 p -112.25 163.7 14.07 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.689 -174.745 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . 0.521 ' CD ' ' H ' ' A' 3633 ' ' GLU . 1.6 mp0 -46.47 -42.75 15.94 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.545 175.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 42.5 t80 -52.27 -52.12 54.55 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.451 177.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 55.1 p -69.69 -51.18 36.78 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.693 -177.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' 3632 ' ' CYS . 13.3 mm-40 -60.35 -44.1 95.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.781 0.324 . . . . 0.0 111.361 -175.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 37.9 t -63.32 -39.51 94.77 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.192 0.52 . . . . 0.0 110.456 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 32.3 m80 -73.84 -33.07 63.98 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.66 177.852 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 75.8 mt -68.33 -37.22 80.34 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.407 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.474 ' CA ' ' HG ' ' A' 3647 ' ' LEU . 21.3 p -72.08 -31.1 65.78 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.255 0.55 . . . . 0.0 110.318 176.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . 0.489 ' HA ' ' CZ ' ' A' 3641 ' ' ARG . 1.2 tpm_? -76.04 -30.7 58.53 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.035 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.781 HD13 HD22 ' A' 3575 ' ' LEU . 16.4 mt -103.71 -32.65 9.27 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -172.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.433 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -148.7 72.74 10.59 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -175.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . 0.462 ' HA ' ' HB3' ' A' 3647 ' ' LEU . 37.1 Cg_endo -65.57 -22.17 58.69 Favored 'Trans proline' 0 C--O 1.234 0.283 0 C-N-CA 122.494 2.13 . . . . 0.0 111.764 179.341 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . 0.415 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 12.1 m-20 -70.1 -45.92 65.94 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.465 -0.788 . . . . 0.0 109.901 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.616 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -84.95 -30.74 24.04 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.575 176.73 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.474 ' HG ' ' CA ' ' A' 3640 ' ' SER . 3.4 tm? -54.19 -48.65 70.73 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.968 -179.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -61.66 -18.44 59.54 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.845 0.355 . . . . 0.0 111.67 -176.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . 0.414 ' OG ' ' HB ' ' A' 3496 ' ' VAL . 6.4 t -89.73 -38.28 13.95 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.189 179.117 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.588 ' HA ' HG22 ' A' 3653 ' ' ILE . 5.1 pt -76.59 -13.32 14.56 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -175.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 50.7 m -63.22 -17.65 62.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.953 0.406 . . . . 0.0 110.756 176.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 8.3 t30 -88.33 -36.71 16.48 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.171 0.51 . . . . 0.0 109.888 173.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.588 HG22 ' HA ' ' A' 3650 ' ' ILE . 8.3 tp -104.85 41.93 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-O 122.41 1.1 . . . . 0.0 109.327 179.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.449 ' N ' ' HD2' ' A' 3655 ' ' PRO . 66.5 m -33.47 -45.7 0.53 Allowed Pre-proline 0 CA--C 1.539 0.536 0 CA-C-N 114.135 -1.393 . . . . 0.0 113.83 170.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.513 ' HG2' HD12 ' A' 3653 ' ' ILE . 14.2 Cg_endo -59.4 84.42 0.06 OUTLIER 'Trans proline' 0 C--N 1.352 0.761 0 C-N-CA 121.511 1.474 . . . . 0.0 111.562 169.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -150.74 170.93 18.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.434 -177.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.489 HD22 HG22 ' A' 3628 ' ' ILE . 43.8 mt -123.17 136.32 54.71 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.559 -179.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 14.5 tmm? -102.7 111.81 24.3 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.825 HD12 HD21 ' A' 3524 ' ' LEU . 70.8 mt -107.31 119.74 57.43 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-O 121.276 0.56 . . . . 0.0 111.529 -170.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.732 HG13 ' HD2' ' A' 3573 ' ' TYR . 81.0 t -102.93 116.5 46.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.77 -179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.667 HD11 HD11 ' A' 3576 ' ' LEU . 55.1 mt -91.05 112.46 25.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 176.016 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -115.16 133.67 55.83 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.433 -177.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.9 m -67.82 110.05 3.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.7 171.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.25 1.084 0 C-N-CA 124.679 1.192 . . . . 0.0 112.75 -174.364 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.483 ' CD1' ' HB2' ' A' 3553 ' ' MET . 40.9 m-85 . . . . . 0 N--CA 1.481 1.076 0 CA-C-O 119.833 -0.127 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.568 ' O ' ' HG2' ' A' 3551 ' ' GLN . 0.5 OUTLIER 54.54 -163.11 0.12 Allowed 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.589 0.709 . . . . 0.0 111.948 178.237 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . . . . . . . . . 10.8 p -145.47 116.15 7.69 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 114.694 -1.139 . . . . 0.0 108.413 167.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.677 HD22 ' CG2' ' A' 3549 ' ' ILE . 3.1 tp -76.72 -126.9 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 119.937 -0.705 . . . . 0.0 110.254 -178.331 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.576 ' HB3' ' HD2' ' A' 3516 ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . 0.635 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 9.1 t70 -176.91 -57.75 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.567 -175.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 14.9 tp10 . . . . . 0 C--O 1.246 0.898 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.689 174.347 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A 3496 ' ' VAL . . . . . . . . . . . . . 20.6 m . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 120.891 0.377 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A 3497 ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -65.19 112.74 3.56 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 121.188 0.518 . . . . 0.0 111.078 -176.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3498 ' ' MET . . . . . . . . . . . . . 71.2 mtm -76.12 -13.72 60.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.193 -179.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3499 ' ' VAL . . . . . 0.415 ' HA ' HD12 ' A' 3502 ' ' LEU . 51.3 t -62.82 -23.3 32.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.627 176.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3500 ' ' GLN . . . . . . . . . . . . . 92.0 mt-30 -76.32 -59.15 2.89 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.205 0.526 . . . . 0.0 110.476 176.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3501 ' ' LEU . . . . . 0.499 HD13 ' HB2' ' A' 3646 ' ' LEU . 2.9 pp -68.41 -32.88 73.25 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -170.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3502 ' ' LEU . . . . . 0.587 HD13 ' N ' ' A' 3503 ' ' LYS . 0.0 OUTLIER -68.94 -14.79 63.25 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 120.292 -0.563 . . . . 0.0 110.339 -174.567 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 3503 ' ' LYS . . . . . 0.587 ' N ' HD13 ' A' 3502 ' ' LEU . 12.2 tmtt? -66.6 -28.99 68.94 Favored 'General case' 0 N--CA 1.455 -0.192 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 176.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3504 ' ' LYS . . . . . . . . . . . . . 25.0 mmtp -99.78 -42.88 6.64 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.356 177.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3505 ' ' TYR . . . . . 0.701 ' HB2' ' O ' ' A' 3526 ' ' PHE . 0.1 OUTLIER -148.17 99.16 3.7 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 121.481 0.657 . . . . 0.0 110.781 -179.703 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 3506 ' ' PRO . . . . . 0.541 ' HA ' ' HB2' ' A' 3502 ' ' LEU . 60.1 Cg_endo -80.29 173.65 12.25 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 123.817 3.011 . . . . 0.0 113.504 -178.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3507 ' ' ILE . . . . . 0.487 ' HA ' ' HA ' ' A' 3525 ' ' HIS . 74.8 mt -71.31 135.73 27.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.112 -176.01 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3508 ' ' VAL . . . . . 0.414 HG13 ' HB2' ' A' 3526 ' ' PHE . 27.3 m -101.91 -29.14 3.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.408 -179.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3509 ' ' TRP . . . . . 0.683 ' HB2' HD13 ' A' 3538 ' ' LEU . 74.7 t-105 -151.96 155.11 37.37 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.641 0.258 . . . . 0.0 110.717 -176.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3510 ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -148.13 118.93 7.56 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 176.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3511 ' ' GLY . . . . . . . . . . . . . . . -167.86 -130.24 1.15 Allowed Glycine 0 N--CA 1.444 -0.824 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -178.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3512 ' ' LEU . . . . . 0.678 ' HG ' ' HA ' ' A' 3521 ' ' ALA . 5.4 mp -139.71 158.05 44.74 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.966 0.412 . . . . 0.0 110.803 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3513 ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' 3519 ' ' THR . 84.1 mt -110.47 149.65 30.0 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 170.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3514 ' ' ALA . . . . . 0.644 ' O ' ' HA ' ' A' 3548 ' ' ARG . . . -143.3 120.96 11.83 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -177.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3515 ' ' LEU . . . . . 0.709 HD12 ' HD3' ' A' 3516 ' ' LYS . 0.2 OUTLIER -138.27 145.75 41.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 172.935 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 3516 ' ' LYS . . . . . 0.709 ' HD3' HD12 ' A' 3515 ' ' LEU . 1.3 mptp? 63.64 -95.79 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 -168.633 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3517 ' ' ASN . . . . . . . . . . . . . 57.2 m-80 -145.27 9.99 1.27 Allowed 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.053 -0.976 . . . . 0.0 108.681 174.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3518 ' ' ASP . . . . . 0.415 ' O ' ' HA ' ' A' 3514 ' ' ALA . 27.3 m-20 -97.28 129.12 44.62 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.423 -174.344 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3519 ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' 3514 ' ' ALA . 31.8 p -117.1 133.58 55.82 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.14 -179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3520 ' ' ALA . . . . . . . . . . . . . . . -126.05 120.85 31.34 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3521 ' ' ALA . . . . . 0.678 ' HA ' ' HG ' ' A' 3512 ' ' LEU . . . -72.17 120.64 18.06 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.086 0.47 . . . . 0.0 109.947 178.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3522 ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' 3579 ' ' LEU . 26.8 m -129.85 147.71 33.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.803 0 CA-C-O 121.625 0.726 . . . . 0.0 111.822 -175.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3523 ' ' GLN . . . . . . . . . . . . . 21.2 pt20 -110.45 124.94 52.7 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.828 173.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3524 ' ' LEU . . . . . 0.796 HD21 HD12 ' A' 3659 ' ' ILE . 0.9 OUTLIER -94.17 109.96 21.72 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.597 -175.136 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 3525 ' ' HIS . . . . . 0.487 ' HA ' ' HA ' ' A' 3507 ' ' ILE . 65.8 m80 -87.58 138.9 31.07 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 114.961 -1.018 . . . . 0.0 108.747 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3526 ' ' PHE . . . . . 0.701 ' O ' ' HB2' ' A' 3505 ' ' TYR . 65.2 t80 -67.56 136.41 54.47 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 108.511 -0.922 . . . . 0.0 108.511 174.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3527 ' ' VAL . . . . . 0.581 ' CG1' HD23 ' A' 3575 ' ' LEU . 26.1 t -114.68 -55.39 4.4 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 121.254 0.549 . . . . 0.0 110.765 176.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3528 ' ' SER . . . . . 0.5 ' OG ' ' HB3' ' A' 3642 ' ' LEU . 72.9 m -162.01 172.53 15.8 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.948 -172.435 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3529 ' ' GLY . . . . . . . . . . . . . . . 89.74 -152.21 22.29 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.338 -0.934 . . . . 0.0 112.166 178.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3530 ' ' ASN . . . . . 0.573 ' HB2' ' HA ' ' A' 3571 ' ' THR . 50.2 t30 -108.34 119.26 38.98 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.889 0.376 . . . . 0.0 110.463 178.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3531 ' ' ASN . . . . . . . . . . . . . 27.1 p-10 -63.41 -27.5 69.34 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.691 -177.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3532 ' ' VAL . . . . . 0.405 ' HB ' ' ND2' ' A' 3530 ' ' ASN . 62.4 t -57.86 -32.79 44.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 121.033 0.444 . . . . 0.0 110.649 178.467 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3533 ' ' LEU . . . . . 0.539 HD23 ' HD3' ' A' 3536 ' ' ARG . 28.3 mt -62.12 -40.61 96.5 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.367 178.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3534 ' ' ALA . . . . . 0.485 ' HA ' HD13 ' A' 3661 ' ' ILE . . . -65.5 -41.86 92.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.954 0.407 . . . . 0.0 110.195 179.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3535 ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -61.03 -37.15 81.58 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.936 179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3536 ' ' ARG . . . . . 0.539 ' HD3' HD23 ' A' 3533 ' ' LEU . 12.6 ptm180 -89.78 -7.98 53.18 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3537 ' ' SER . . . . . 0.496 ' HB2' HD11 ' A' 3626 ' ' LEU . 41.1 p -105.14 -40.5 5.85 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.783 0.325 . . . . 0.0 111.621 179.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3538 ' ' LEU . . . . . 0.683 HD13 ' HB2' ' A' 3509 ' ' TRP . 28.2 mt -79.14 110.3 14.31 Favored Pre-proline 0 C--N 1.322 -0.598 0 CA-C-O 121.281 0.562 . . . . 0.0 109.708 -173.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3539 ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -80.18 147.63 18.6 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 123.123 2.548 . . . . 0.0 113.273 -170.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3540 ' ' LEU . . . . . 0.53 ' HB3' ' CH2' ' A' 3509 ' ' TRP . 4.4 pp -137.81 162.15 34.7 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.932 177.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3541 ' ' SER . . . . . . . . . . . . . 41.2 t -178.63 -45.26 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.313 0.577 . . . . 0.0 109.584 -175.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3542 ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -138.94 96.25 3.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.203 -178.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3543 ' ' GLY . . . . . . . . . . . . . . . 64.53 -90.52 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.854 -0.689 . . . . 0.0 111.543 -175.443 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3544 ' ' GLY . . . . . . . . . . . . . . . -152.77 95.57 0.16 Allowed Glycine 0 N--CA 1.446 -0.652 0 N-CA-C 111.004 -0.838 . . . . 0.0 111.004 175.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3545 ' ' PRO . . . . . 0.45 ' CD ' ' HA ' ' A' 3540 ' ' LEU . 31.9 Cg_exo -60.12 149.29 85.67 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 123.426 2.75 . . . . 0.0 113.144 -176.739 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3546 ' ' PRO . . . . . 0.583 ' HA ' ' O ' ' A' 3512 ' ' LEU . 87.4 Cg_endo -80.71 141.37 13.62 Favored 'Trans proline' 0 N--CA 1.455 -0.756 0 C-N-CA 122.761 2.308 . . . . 0.0 112.733 179.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3547 ' ' LEU . . . . . 0.672 ' HB3' HD13 ' A' 3612 ' ' ILE . 30.3 mt -85.95 115.24 23.44 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.131 176.13 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3548 ' ' ARG . . . . . 0.644 ' HA ' ' O ' ' A' 3514 ' ' ALA . 37.7 ptt85 -91.35 140.76 29.47 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.19 -175.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3549 ' ' ILE . . . . . 0.549 ' CG2' HD22 ' B' 2521 ' ' LEU . 17.3 mt -96.14 107.26 19.45 Favored 'Isoleucine or valine' 0 C--O 1.249 1.045 0 CA-C-O 122.5 1.143 . . . . 0.0 111.458 -177.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3550 ' ' ALA . . . . . 0.56 ' C ' ' H ' ' B' 2521 ' ' LEU . . . -114.94 4.63 14.84 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 114.627 -1.17 . . . . 0.0 111.92 -172.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3551 ' ' GLN . . . . . 0.731 ' CB ' ' HB ' ' A' 3611 ' ' ILE . 62.6 mt-30 -155.0 167.22 31.08 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 122.469 0.308 . . . . 0.0 110.804 177.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3552 ' ' ARG . . . . . 0.686 ' HA ' ' O ' ' A' 3609 ' ' ALA . 0.0 OUTLIER -149.03 134.04 18.11 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 121.072 0.463 . . . . 0.0 111.228 177.508 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 3553 ' ' MET . . . . . 0.623 ' HB3' ' HB3' ' A' 3609 ' ' ALA . 14.6 tmm? -108.76 116.34 31.79 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.329 178.609 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3554 ' ' ARG . . . . . . . . . . . . . 14.6 mmt180 -65.25 110.24 2.51 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 -179.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3555 ' ' LEU . . . . . 0.637 ' O ' HD12 ' A' 3555 ' ' LEU . 2.1 pp -69.67 98.71 1.21 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 122.053 0.93 . . . . 0.0 110.233 -175.345 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3556 ' ' GLU . . . . . 0.627 ' O ' ' HG ' ' A' 3560 ' ' LEU . 37.4 mt-10 -107.67 167.11 10.19 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.567 177.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3557 ' ' ALA . . . . . 0.515 ' O ' ' HG2' ' A' 3561 ' ' GLU . . . -57.71 -48.19 80.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.902 0.382 . . . . 0.0 110.238 178.799 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3558 ' ' THR . . . . . . . . . . . . . 1.7 p -62.29 -34.01 75.77 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.715 178.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3559 ' ' GLN . . . . . 0.551 ' O ' HG23 ' A' 3563 ' ' VAL . 86.8 mm-40 -74.38 -40.04 62.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.868 -179.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3560 ' ' LEU . . . . . 0.627 ' HG ' ' O ' ' A' 3556 ' ' GLU . 74.9 mt -63.98 -34.18 77.41 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.4 179.093 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3561 ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' 3557 ' ' ALA . 19.1 mm-40 -61.71 -45.6 93.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.13 0.49 . . . . 0.0 109.982 174.041 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3562 ' ' GLY . . . . . . . . . . . . . . . -58.06 -44.96 94.43 Favored Glycine 0 N--CA 1.453 -0.186 0 CA-C-N 115.302 -0.863 . . . . 0.0 112.214 175.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3563 ' ' VAL . . . . . 0.617 ' O ' ' HG3' ' A' 3567 ' ' MET . 40.2 t -61.83 -50.52 79.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 120.823 0.344 . . . . 0.0 110.28 177.009 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3564 ' ' ALA . . . . . 0.403 ' HA ' ' HB2' ' A' 3567 ' ' MET . . . -58.45 -31.89 68.19 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.158 -0.473 . . . . 0.0 111.695 -178.556 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3565 ' ' ARG . . . . . 0.489 ' O ' HG22 ' A' 3568 ' ' THR . 31.6 ttp85 -54.3 -46.21 72.72 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.745 178.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3566 ' ' ARG . . . . . 0.428 ' HG2' ' O ' ' A' 3563 ' ' VAL . 16.9 ptt-85 -86.63 -12.74 47.65 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.872 -179.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3567 ' ' MET . . . . . 0.617 ' HG3' ' O ' ' A' 3563 ' ' VAL . 86.3 mtp -78.25 -27.02 47.48 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.871 0.367 . . . . 0.0 110.742 178.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3568 ' ' THR . . . . . 0.489 HG22 ' O ' ' A' 3565 ' ' ARG . 7.7 t -82.91 1.34 39.99 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.197 0.522 . . . . 0.0 110.276 179.616 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3569 ' ' VAL . . . . . . . . . . . . . 51.7 t -128.42 87.41 1.08 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.689 176.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3570 ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -70.4 109.21 4.63 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3571 ' ' THR . . . . . 0.573 ' HA ' ' HB2' ' A' 3530 ' ' ASN . 2.4 m 151.17 -38.53 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 125.418 1.487 . . . . 0.0 108.438 -176.404 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3572 ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -82.36 -29.98 30.62 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.263 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3573 ' ' TYR . . . . . 0.739 ' HD2' HG13 ' A' 3660 ' ' VAL . 0.1 OUTLIER -127.25 163.55 23.68 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.873 176.249 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 3574 ' ' CYS . . . . . 0.614 ' HB3' ' HB ' ' A' 3661 ' ' ILE . 28.0 t -128.25 136.48 51.09 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 171.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3575 ' ' LEU . . . . . 0.753 HD22 HD13 ' A' 3642 ' ' LEU . 13.1 tp -106.06 125.61 51.2 Favored 'General case' 0 C--N 1.312 -1.058 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3576 ' ' LEU . . . . . 0.605 HD11 HD11 ' A' 3661 ' ' ILE . 79.7 mt -127.61 155.58 43.63 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.138 0.494 . . . . 0.0 110.825 -177.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3577 ' ' LEU . . . . . 0.706 ' HG ' HD11 ' A' 3646 ' ' LEU . 0.4 OUTLIER -123.03 107.9 12.31 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.387 179.776 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 3578 ' ' ALA . . . . . 0.492 ' HB2' HD12 ' A' 3659 ' ' ILE . . . -94.27 123.53 37.72 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.325 0.584 . . . . 0.0 110.501 -177.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3579 ' ' LEU . . . . . 0.448 ' O ' ' HA ' ' A' 3522 ' ' VAL . 53.6 mt -124.29 144.24 45.13 Favored Pre-proline 0 C--N 1.323 -0.573 0 CA-C-N 114.97 -1.013 . . . . 0.0 110.328 -179.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3580 ' ' PRO . . . . . 0.406 ' HA ' ' O ' ' A' 3521 ' ' ALA . 18.2 Cg_endo -60.57 113.06 1.53 Allowed 'Trans proline' 0 N--CA 1.462 -0.36 0 C-N-CA 122.37 2.047 . . . . 0.0 111.452 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3581 ' ' CYS . . . . . . . . . . . . . 25.2 p -99.28 107.79 20.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.349 0.595 . . . . 0.0 110.362 -178.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3582 ' ' GLY . . . . . 0.439 ' HA2' ' OD2' ' A' 3587 ' ' ASP . . . -98.28 145.6 17.83 Favored Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 120.582 -0.818 . . . . 0.0 111.563 179.432 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3583 ' ' ARG . . . . . 0.404 ' HG2' ' OD2' ' A' 3587 ' ' ASP . 27.2 mmt-85 -64.4 -43.04 95.67 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.341 -0.615 . . . . 0.0 109.341 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3584 ' ' ASP . . . . . 0.612 ' O ' HG23 ' A' 3588 ' ' VAL . 5.3 p-10 -134.65 -179.77 5.8 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.096 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3585 ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -57.7 -43.6 85.28 Favored 'General case' 0 C--N 1.328 -0.339 0 O-C-N 123.102 0.251 . . . . 0.0 111.336 -175.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3586 ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -65.33 -43.85 89.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.345 179.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3587 ' ' ASP . . . . . 0.439 ' OD2' ' HA2' ' A' 3582 ' ' GLY . 26.8 t70 -60.84 -44.67 96.65 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.398 -179.172 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3588 ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' 3584 ' ' ASP . 98.4 t -56.52 -39.82 64.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.71 178.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3589 ' ' VAL . . . . . 0.442 ' O ' ' HG2' ' A' 3593 ' ' GLU . 13.1 t -64.87 -51.1 71.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 121.582 0.706 . . . . 0.0 109.641 -179.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3590 ' ' SER . . . . . . . . . . . . . 34.3 m -64.32 -37.99 89.46 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 114.5 -1.227 . . . . 0.0 112.196 -177.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3591 ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -71.42 -37.17 71.48 Favored 'General case' 0 C--N 1.327 -0.385 0 O-C-N 122.128 -0.358 . . . . 0.0 111.061 177.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3592 ' ' THR . . . . . . . . . . . . . 89.2 m -63.32 -50.07 71.45 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.644 0.259 . . . . 0.0 110.818 178.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3593 ' ' GLU . . . . . 0.547 ' HA ' ' HE2' ' A' 3596 ' ' LYS . 8.8 pt-20 -64.2 -37.11 86.3 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.97 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3594 ' ' SER . . . . . . . . . . . . . 7.6 t -67.52 -43.12 81.57 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.822 0.344 . . . . 0.0 110.232 179.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3595 ' ' LEU . . . . . 0.56 HD12 ' HB2' ' A' 3599 ' ' PHE . 61.4 tp -63.42 -46.63 85.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.101 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3596 ' ' LYS . . . . . 0.832 ' HA ' ' CG1' ' A' 3600 ' ' ILE . 57.5 pttt -67.84 -30.58 70.01 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 120.123 -0.631 . . . . 0.0 111.008 -177.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3597 ' ' ALA . . . . . . . . . . . . . . . -76.78 -38.44 54.02 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.729 0.299 . . . . 0.0 111.57 179.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3598 ' ' ALA . . . . . 0.407 ' O ' ' HB3' ' A' 3602 ' ' TYR . . . -93.91 -45.93 7.4 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -171.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3599 ' ' PHE . . . . . 0.56 ' HB2' HD12 ' A' 3595 ' ' LEU . 12.0 m-85 -98.97 -50.07 4.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.651 0.262 . . . . 0.0 111.683 -175.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3600 ' ' ILE . . . . . 0.832 ' CG1' ' HA ' ' A' 3596 ' ' LYS . 31.6 mm -61.88 -60.08 3.28 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.261 -175.597 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3601 ' ' THR . . . . . . . . . . . . . 74.8 m -53.29 -40.92 65.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.675 0.274 . . . . 0.0 111.089 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3602 ' ' TYR . . . . . 0.78 ' CE2' HD22 ' A' 3603 ' ' LEU . 0.1 OUTLIER -64.71 -57.07 9.99 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.082 179.503 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 3603 ' ' LEU . . . . . 0.78 HD22 ' CE2' ' A' 3602 ' ' TYR . 0.1 OUTLIER -57.99 -41.62 83.39 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.644 0.259 . . . . 0.0 111.43 -177.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 3604 ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -72.66 -36.09 67.87 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.567 -176.736 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3605 ' ' ALA . . . . . . . . . . . . . . . -70.92 -31.74 68.44 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 120.942 0.401 . . . . 0.0 110.961 178.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3606 ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -81.2 -19.1 44.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.78 177.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3607 ' ' GLN . . . . . 0.551 ' O ' ' HG ' ' A' 3555 ' ' LEU . 46.3 mt-30 50.39 52.06 15.57 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 -171.003 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3608 ' ' ALA . . . . . 0.474 ' O ' HD12 ' A' 3603 ' ' LEU . . . -135.45 -176.19 4.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.193 -171.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3609 ' ' ALA . . . . . 0.686 ' O ' ' HA ' ' A' 3552 ' ' ARG . . . -119.4 117.97 29.91 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.537 176.452 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3610 ' ' GLY . . . . . . . . . . . . . . . -65.24 102.4 0.66 Allowed Glycine 0 N--CA 1.446 -0.641 0 N-CA-C 111.244 -0.742 . . . . 0.0 111.244 177.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3611 ' ' ILE . . . . . 0.731 ' HB ' ' CB ' ' A' 3551 ' ' GLN . 32.4 mm -89.3 126.18 42.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-O 121.201 0.525 . . . . 0.0 110.762 -175.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3612 ' ' ILE . . . . . 0.672 HD13 ' HB3' ' A' 3547 ' ' LEU . 34.1 mt -122.07 112.92 36.74 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.221 177.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3613 ' ' ASN . . . . . . . . . . . . . 15.5 m120 -84.64 111.7 19.79 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.121 -179.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3614 ' ' VAL . . . . . 0.547 ' O ' ' HA ' ' A' 3622 ' ' PRO . 34.8 m -109.47 144.66 30.29 Favored Pre-proline 0 C--N 1.321 -0.641 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.662 179.604 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3615 ' ' PRO . . . . . 0.492 ' HA ' ' O ' ' A' 3621 ' ' GLN . 97.7 Cg_endo -92.68 140.46 1.96 Allowed 'Trans proline' 0 N--CA 1.444 -1.398 0 C-N-CA 122.4 2.067 . . . . 0.0 112.118 173.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3616 ' ' ASN . . . . . 0.504 ' HB2' ' CE2' ' A' 3624 ' ' TYR . 25.3 t-20 -79.8 118.92 74.9 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.4 178.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3617 ' ' PRO . . . . . . . . . . . . . 73.8 Cg_exo -50.72 124.96 14.56 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 123.011 2.474 . . . . 0.0 112.103 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3618 ' ' GLY . . . . . . . . . . . . . . . 106.47 -50.13 0.83 Allowed Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 120.917 -0.658 . . . . 0.0 111.719 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3619 ' ' SER . . . . . . . . . . . . . 15.3 m -91.37 -29.06 17.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.175 0.512 . . . . 0.0 110.144 178.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3620 ' ' ASN . . . . . . . . . . . . . 3.2 m-20 62.63 17.71 9.93 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.018 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3621 ' ' GLN . . . . . 0.492 ' O ' ' HA ' ' A' 3615 ' ' PRO . 78.6 mt-30 -82.53 120.3 76.42 Favored Pre-proline 0 C--N 1.326 -0.446 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.028 179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3622 ' ' PRO . . . . . 0.547 ' HA ' ' O ' ' A' 3614 ' ' VAL . 91.4 Cg_endo -80.8 24.79 0.65 Allowed 'Trans proline' 0 C--O 1.233 0.253 0 C-N-CA 123.405 2.736 . . . . 0.0 112.444 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3623 ' ' ALA . . . . . . . . . . . . . . . -77.77 44.54 0.46 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.175 0.512 . . . . 0.0 111.651 -176.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3624 ' ' TYR . . . . . 0.504 ' CE2' ' HB2' ' A' 3616 ' ' ASN . 80.7 m-85 -134.82 133.04 39.35 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.962 177.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3625 ' ' VAL . . . . . 0.455 HG13 HG23 ' A' 3611 ' ' ILE . 3.1 t -118.97 115.57 48.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.067 179.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3626 ' ' LEU . . . . . 0.629 ' HG ' HG12 ' A' 3661 ' ' ILE . 6.8 mp -97.82 113.79 25.68 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 169.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3627 ' ' GLN . . . . . 0.575 ' HG2' ' CD1' ' A' 3611 ' ' ILE . 95.0 mt-30 -94.48 111.42 23.17 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.225 -178.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3628 ' ' ILE . . . . . 0.595 HG12 HG12 ' A' 3659 ' ' ILE . 40.9 mt -92.08 98.22 8.12 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.034 178.265 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3629 ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -88.96 141.94 29.94 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.855 178.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3630 ' ' PRO . . . . . 0.604 ' HB3' ' HB3' ' A' 3603 ' ' LEU . 56.6 Cg_endo -70.83 169.24 20.75 Favored 'Trans proline' 0 CA--C 1.529 0.26 0 C-N-CA 122.487 2.125 . . . . 0.0 111.414 176.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3631 ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -68.0 74.31 0.7 Allowed 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.684 2.256 . . . . 0.0 111.833 176.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3632 ' ' CYS . . . . . 0.587 ' O ' ' HG2' ' A' 3636 ' ' GLU . 9.0 p -111.69 163.34 14.23 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.642 -174.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3633 ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -47.69 -41.66 23.08 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.738 177.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3634 ' ' PHE . . . . . . . . . . . . . 39.1 t80 -53.91 -52.42 60.59 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.441 177.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3635 ' ' SER . . . . . . . . . . . . . 56.4 p -70.29 -53.55 16.38 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 116.554 -0.294 . . . . 0.0 110.686 -177.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3636 ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' 3632 ' ' CYS . 6.1 mm-40 -56.21 -44.76 79.82 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 123.445 0.466 . . . . 0.0 111.072 -174.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3637 ' ' SER . . . . . . . . . . . . . 48.4 t -61.97 -53.11 60.14 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.565 -178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3638 ' ' HIS . . . . . . . . . . . . . 43.2 m80 -61.62 -34.86 76.4 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.573 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3639 ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.55 -31.3 71.29 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.315 177.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3640 ' ' SER . . . . . 0.635 ' HA ' ' HG ' ' A' 3647 ' ' LEU . 21.8 m -71.16 -29.91 65.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.33 0.586 . . . . 0.0 110.035 -178.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3641 ' ' ARG . . . . . . . . . . . . . 71.7 ttt180 -89.05 -44.57 10.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.424 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3642 ' ' LEU . . . . . 0.753 HD13 HD22 ' A' 3575 ' ' LEU . 22.8 mt -78.48 -30.85 47.55 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.246 -0.434 . . . . 0.0 112.17 -173.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3643 ' ' ALA . . . . . 0.459 ' CB ' HG13 ' A' 3527 ' ' VAL . . . -150.78 69.54 8.55 Favored Pre-proline 0 C--N 1.328 -0.354 0 CA-C-O 120.456 0.17 . . . . 0.0 111.369 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3644 ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.0 -19.39 66.4 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.417 2.078 . . . . 0.0 111.731 -179.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3645 ' ' ASP . . . . . 0.447 ' HB2' ' OH ' ' A' 3505 ' ' TYR . 18.1 m-20 -72.83 -51.42 18.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.204 -177.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3646 ' ' LEU . . . . . 0.706 HD11 ' HG ' ' A' 3577 ' ' LEU . 0.1 OUTLIER -79.5 -29.94 41.77 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 179.183 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 3647 ' ' LEU . . . . . 0.635 ' HG ' ' HA ' ' A' 3640 ' ' SER . 3.4 tm? -54.26 -45.72 72.48 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.424 178.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3648 ' ' ALA . . . . . . . . . . . . . . . -60.32 -31.13 69.99 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.96 0.409 . . . . 0.0 111.119 -178.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3649 ' ' SER . . . . . . . . . . . . . 15.3 m -76.78 -36.56 56.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.852 179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3650 ' ' ILE . . . . . 0.761 ' HA ' HG22 ' A' 3653 ' ' ILE . 7.0 pt -83.5 -9.89 11.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-O 120.925 0.393 . . . . 0.0 111.293 -176.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3651 ' ' SER . . . . . . . . . . . . . 8.3 t -60.18 -25.53 65.63 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.329 176.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3652 ' ' ASN . . . . . . . . . . . . . 17.9 m120 -88.01 -32.56 18.75 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 121.033 0.444 . . . . 0.0 110.305 175.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3653 ' ' ILE . . . . . 0.761 HG22 ' HA ' ' A' 3650 ' ' ILE . 0.4 OUTLIER -104.68 36.1 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 CA-C-O 122.847 1.308 . . . . 0.0 109.16 -177.121 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A 3654 ' ' SER . . . . . 0.428 ' N ' ' HD2' ' A' 3655 ' ' PRO . 49.5 m -30.31 -45.61 0.26 Allowed Pre-proline 0 N--CA 1.473 0.701 0 CA-C-N 113.966 -1.47 . . . . 0.0 114.433 172.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3655 ' ' PRO . . . . . 0.547 ' HG2' HD13 ' A' 3653 ' ' ILE . 11.9 Cg_endo -58.28 80.74 0.05 OUTLIER 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 121.826 1.684 . . . . 0.0 111.842 169.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3656 ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -146.91 169.39 19.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.762 -176.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3657 ' ' LEU . . . . . 0.492 HD22 HG22 ' A' 3628 ' ' ILE . 50.3 mt -121.64 137.15 54.87 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.656 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3658 ' ' MET . . . . . . . . . . . . . 15.3 tmm? -104.39 112.55 25.64 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 177.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3659 ' ' ILE . . . . . 0.796 HD12 HD21 ' A' 3524 ' ' LEU . 73.1 mt -106.62 121.27 59.07 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.237 0.542 . . . . 0.0 111.59 -171.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3660 ' ' VAL . . . . . 0.739 HG13 ' HD2' ' A' 3573 ' ' TYR . 79.5 t -104.47 116.43 48.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.914 -179.325 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3661 ' ' ILE . . . . . 0.629 HG12 ' HG ' ' A' 3626 ' ' LEU . 73.4 mt -91.07 115.72 30.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 176.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A 3662 ' ' ALA . . . . . . . . . . . . . . . -122.96 133.58 54.37 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 120.969 -0.292 . . . . 0.0 111.226 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3663 ' ' SER . . . . . . . . . . . . . 49.1 m -78.49 110.19 13.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 174.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A 3664 ' ' VAL . . . . . 0.432 HG11 HG23 ' A' 3625 ' ' VAL . 3.4 p . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.921 -1.038 . . . . 0.0 111.262 -175.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 2518 ' ' TYR . . . . . 0.575 ' CD1' ' HB2' ' A' 3553 ' ' MET . 7.6 m-85 . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 119.17 -0.443 . . . . 0.0 112.144 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 2519 ' ' GLU . . . . . 0.552 ' HG2' ' HE ' ' A' 3552 ' ' ARG . 30.6 tt0 44.49 95.94 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 172.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 2520 ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' 3550 ' ' ALA . 17.5 p -57.64 131.12 49.29 Favored 'General case' 0 C--N 1.322 -0.593 0 O-C-N 122.291 -0.256 . . . . 0.0 111.189 -179.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 2521 ' ' LEU . . . . . 0.654 ' HG ' ' N ' ' B' 2522 ' ' SEP . 16.7 tp -81.98 -118.36 0.02 OUTLIER 'General case' 0 C--O 1.234 0.238 0 C-N-CA 121.178 -0.209 . . . . 0.0 110.558 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 2522 ' ' SEP . . . . . 0.654 ' N ' ' HG ' ' B' 2521 ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B 2523 ' ' ASP . . . . . 0.591 ' OD2' ' HD2' ' A' 3548 ' ' ARG . 6.1 t70 -146.01 -65.63 0.3 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.886 178.153 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B 2524 ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B 2525 ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 . . . . . 0 C--O 1.247 0.966 0 CA-C-O 118.694 -0.669 . . . . 0.0 109.868 175.495 . . . . . . . . 0 0 . 1 stop_ save_