mol="5XU"	Charge="0"
lab="N"	NH="2"
lab="CA"	NH="1"
lab="C"	NH="1"
lab="O"	NH="0"
lab="CB"	NH="3"
lab="H"	NH="0"
lab="H2"	NH="0"
lab="HA"	NH="0"
lab="HB1"	NH="0"
lab="HB2"	NH="0"
lab="HB3"	NH="0"
lab="HXT"	NH="0"
