ACE 1 3 4 HA CA C O ALA 3 1 1 H N -C CA 1 5 HA CA N C CB 3 4 HB CB CA N ARG 8 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 2 6 HG CG CD CB 2 6 HD CD NE CG 1 1 HE NE CD CZ 2 3 HH1 NH1 CZ NE 2 3 HH2 NH2 CZ NE ASN 4 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 2 3 HD2 ND2 CG CB ASP 3 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA ASPH 4 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 1 2 HD1 OD1 CG CB CYS2 3 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB SG CA CYSH 4 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB SG CA 1 2 HG SG CB CA FAD 7 2 3 HN6 AN6 AC6 AC5 1 2 HO2* AO2* AC2* AC1* 1 2 HO3* AO3* AC3* AC2* 1 2 H4* O4* C4* C5* 1 2 H3* O3* C3* C4* 1 2 H2* O2* C2* C3* 1 2 H3 N3 C4 C4A GLN 5 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 2 6 HG CG CD CB 2 3 HE2 NE2 CD CG GLU 4 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 2 6 HG CG CD CB GLUH 5 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 2 6 HG CG CD CB 1 2 HE2 OE2 CD CG GLY 2 1 1 H N -C CA 2 6 HA CA C N HEME 18 3 4 HMA CMA C3A C4A 3 4 HMB CMB C2B C3B 3 4 HMC CMC C2C C3C 3 4 HMD CMD C2D C1D 3 4 HBC CBC CAC C3C 2 6 HAC CAC C3C CBC 2 6 HAB CAB CBB C3B 3 4 HBB CBB CAB C3B 1 1 HHC CHC C4B C1C 1 1 HHD CHD C4C C1D 1 1 HHB CHB C4A C1B 1 1 HHA CHA C4D C1A 2 6 HBA CBA CAA CGA 2 6 HAA CAA CBA C2A 2 6 HBD CBD CAD CGD 2 6 HAD CAD CBD C2D 1 4 H2A O2A CGA CBA 1 4 H2D O2D CGD CBD HIS1 6 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 1 1 HD2 CD2 CG NE2 1 1 HE1 CE1 ND1 NE2 1 1 HD1 ND1 CG CE1 HISA 6 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 1 1 HD1 ND1 CG CE1 1 1 HD2 CD2 CG NE2 1 1 HE1 CE1 ND1 NE2 HISB 6 1 1 H N -C CA 2 6 HB CB CG CA 1 5 HA CA N C CB 1 1 HE2 NE2 CE1 CD2 1 1 HD2 CD2 CG NE2 1 1 HE1 CE1 ND1 NE2 HISH 7 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 1 1 HD2 CD2 CG NE2 1 1 HE1 CE1 ND1 NE2 1 1 HD1 ND1 CG CE1 1 1 HE2 NE2 CE1 CD2 HO4 1 3 10 HW OW HOH 1 2 7 HW OW HYP 3 1 5 HA CA N C CB 1 2 HD1 OD1 CG CB 1 5 HG CG CB OD1 CD2 ILE 6 1 1 H N -C CA 1 5 HA CA N C CB 1 5 HB CB CA CG1 CG2 2 6 HG1 CG1 CD CB 3 4 HG2 CG2 CB CA 3 4 HD CD CG1 CB LEU 6 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 1 5 HG CG CB CD1 CD2 3 4 HD1 CD1 CG CB 3 4 HD2 CD2 CG CB LYS 7 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 2 6 HG CG CD CB 2 6 HD CD CE CG 2 6 HE CE NZ CD 2 4 HZ NZ CE CD LYSH 7 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 2 6 HG CG CD CB 2 6 HD CD CE CG 2 6 HE CE NZ CD 3 4 HZ NZ CE CD MET 5 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 2 6 HG CG SD CB 3 4 HE CE SD CG NAC 2 1 1 H N -C CA 3 4 HA CA N -C NH2 1 2 3 H N -C -CA OCT 8 3 4 H1 C1 C2 C3 2 6 H2 C2 C1 C3 2 6 H3 C3 C2 C4 2 6 H4 C4 C3 C5 2 6 H5 C5 C4 C6 2 6 H6 C6 C5 C7 2 6 H7 C7 C6 C8 2 6 H8 C8 C7 O9 PHE 8 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 1 1 HD1 CD1 CG CE1 1 1 HD2 CD2 CG CE2 1 1 HE1 CE1 CD1 CZ 1 1 HE2 CE2 CD2 CZ 1 1 HZ CZ CE1 CE2 PRO 4 1 5 HA CA N C CB 2 6 HB CB CG CA 2 6 HG CG CD CB 2 6 HD CD N CG SER 4 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB OG CA 1 2 HG OG CB CA TFE 1 1 2 H O C2 C1 THR 5 1 1 H N -C CA 1 5 HA CA N C CB 1 5 HB CB CA OG1 CG2 1 2 HG1 OG1 CB CA 3 4 HG2 CG2 CB CA TRP 9 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 1 1 HD1 CD1 NE1 CG 1 1 HE1 NE1 CD1 CE2 1 1 HE3 CE3 CD2 CZ3 1 1 HZ3 CZ3 CE3 CH2 1 1 HH2 CH2 CZ3 CZ2 1 1 HZ2 CZ2 CE2 CH2 TYR 8 1 1 H N -C CA 1 5 HA CA N C CB 2 6 HB CB CG CA 1 1 HD1 CD1 CG CE1 1 1 HD2 CD2 CG CE2 1 1 HE1 CE1 CD1 CZ 1 1 HE2 CE2 CD2 CZ 1 2 HH OH CZ CE1 VAL 5 1 1 H N -C CA 1 5 HA CA N C CB 1 5 HB CB CA CG1 CG2 3 4 HG1 CG1 CB CA 3 4 HG2 CG2 CB CA