mol="1NJ" Charge="0"
lab="O1"	NH="0" 
lab="C2"	NH="0" 
lab="N3"	NH="1" 
lab="C5"	NH="0" 
lab="C6"	NH="1" 
lab="C8"	NH="1" 
lab="C10"	NH="0" 
lab="C11"	NH="0" 
lab="N12"	NH="2" 
lab="N15"	NH="1" 
lab="C17"	NH="1" 
lab="C19"	NH="1" 
lab="C21"	NH="0" 
lab="N22"	NH="0" 
lab="C23"	NH="0" 
lab="O24"	NH="0" 
lab="C25"	NH="3" 
lab="C29"	NH="1" 
lab="C31"	NH="1" 
lab="C33"	NH="0" 
lab="C34"	NH="0" 
lab="C35"	NH="1" 
lab="C37"	NH="1" 
lab="C39"	NH="0" 
lab="C40"	NH="0" 
lab="O41"	NH="0" 
lab="O43"	NH="1" 
lab="C44"	NH="1" 
lab="C46"	NH="0" 
lab="C47"	NH="0" 
lab="O48"	NH="0" 
lab="N49"	NH="1" 
lab="C51"	NH="1" 
lab="C53"	NH="2" 
lab="O56"	NH="1" 
lab="C58"	NH="0" 
lab="C59"	NH="3" 
lab="C63"	NH="3" 
lab="C67"	NH="3" 
