ffcharge 0.2.1

scheme,position,residue,atom,charge
amber-ffsb,m,ALA,N,-0.4157000
amber-ffsb,m,ALA,H,0.2719000
amber-ffsb,m,ALA,CA,0.0337000
amber-ffsb,m,ALA,HA,0.0823000
amber-ffsb,m,ALA,CB,-0.1825000
amber-ffsb,m,ALA,HB1,0.0603000
amber-ffsb,m,ALA,HB2,0.0603000
amber-ffsb,m,ALA,HB3,0.0603000
amber-ffsb,m,ALA,C,0.5973000
amber-ffsb,m,ALA,O,-0.5679000
amber-ffsb,n,ALA,N,0.1414000
amber-ffsb,n,ALA,H1,0.1997000
amber-ffsb,n,ALA,H2,0.1997000
amber-ffsb,n,ALA,H3,0.1997000
amber-ffsb,n,ALA,CA,0.0962000
amber-ffsb,n,ALA,HA,0.0889000
amber-ffsb,n,ALA,CB,-0.0597000
amber-ffsb,n,ALA,HB1,0.0300000
amber-ffsb,n,ALA,HB2,0.0300000
amber-ffsb,n,ALA,HB3,0.0300000
amber-ffsb,n,ALA,C,0.6163000
amber-ffsb,n,ALA,O,-0.5722000
amber-ffsb,c,ALA,N,-0.3821000
amber-ffsb,c,ALA,H,0.2681000
amber-ffsb,c,ALA,CA,-0.1747000
amber-ffsb,c,ALA,HA,0.1067000
amber-ffsb,c,ALA,CB,-0.2093000
amber-ffsb,c,ALA,HB1,0.0764000
amber-ffsb,c,ALA,HB2,0.0764000
amber-ffsb,c,ALA,HB3,0.0764000
amber-ffsb,c,ALA,C,0.7731000
amber-ffsb,c,ALA,O,-0.8055000
amber-ffsb,c,ALA,OXT,-0.8055000
amber-ffsb,n-,ALA,N,-0.6589000
amber-ffsb,n-,ALA,H1,0.1997000
amber-ffsb,n-,ALA,H2,0.1997000
amber-ffsb,n-,ALA,CA,0.0962000
amber-ffsb,n-,ALA,HA,0.0889000
amber-ffsb,n-,ALA,CB,-0.0597000
amber-ffsb,n-,ALA,HB1,0.0300000
amber-ffsb,n-,ALA,HB2,0.0300000
amber-ffsb,n-,ALA,HB3,0.0300000
amber-ffsb,n-,ALA,C,0.6163000
amber-ffsb,n-,ALA,O,-0.5722000
amber-ffsb,c+,ALA,N,-0.3821000
amber-ffsb,c+,ALA,H,0.2681000
amber-ffsb,c+,ALA,CA,-0.1747000
amber-ffsb,c+,ALA,HA,0.1067000
amber-ffsb,c+,ALA,CB,-0.2093000
amber-ffsb,c+,ALA,HB1,0.0764000
amber-ffsb,c+,ALA,HB2,0.0764000
amber-ffsb,c+,ALA,HB3,0.0764000
amber-ffsb,c+,ALA,C,0.7731000
amber-ffsb,c+,ALA,O,-0.5380000
amber-ffsb,c+,ALA,OXT,-0.5380000
amber-ffsb,c+,ALA,HOXT,0.4650000
amber-ffsb,m,ARG,N,-0.3479000
amber-ffsb,m,ARG,H,0.2747000
amber-ffsb,m,ARG,CA,-0.2637000
amber-ffsb,m,ARG,HA,0.1560000
amber-ffsb,m,ARG,CB,-0.0007000
amber-ffsb,m,ARG,HB2,0.0327000
amber-ffsb,m,ARG,HB3,0.0327000
amber-ffsb,m,ARG,CG,0.0390000
amber-ffsb,m,ARG,HG2,0.0285000
amber-ffsb,m,ARG,HG3,0.0285000
amber-ffsb,m,ARG,CD,0.0486000
amber-ffsb,m,ARG,HD2,0.0687000
amber-ffsb,m,ARG,HD3,0.0687000
amber-ffsb,m,ARG,NE,-0.5295000
amber-ffsb,m,ARG,HE,0.3456000
amber-ffsb,m,ARG,CZ,0.8076000
amber-ffsb,m,ARG,NH1,-0.8627000
amber-ffsb,m,ARG,HH11,0.4478000
amber-ffsb,m,ARG,HH12,0.4478000
amber-ffsb,m,ARG,NH2,-0.8627000
amber-ffsb,m,ARG,HH21,0.4478000
amber-ffsb,m,ARG,HH22,0.4478000
amber-ffsb,m,ARG,C,0.7341000
amber-ffsb,m,ARG,O,-0.5894000
amber-ffsb,n,ARG,N,0.1305000
amber-ffsb,n,ARG,H1,0.2083000
amber-ffsb,n,ARG,H2,0.2083000
amber-ffsb,n,ARG,H3,0.2083000
amber-ffsb,n,ARG,CA,-0.0223000
amber-ffsb,n,ARG,HA,0.1242000
amber-ffsb,n,ARG,CB,0.0118000
amber-ffsb,n,ARG,HB2,0.0226000
amber-ffsb,n,ARG,HB3,0.0226000
amber-ffsb,n,ARG,CG,0.0236000
amber-ffsb,n,ARG,HG2,0.0309000
amber-ffsb,n,ARG,HG3,0.0309000
amber-ffsb,n,ARG,CD,0.0935000
amber-ffsb,n,ARG,HD2,0.0527000
amber-ffsb,n,ARG,HD3,0.0527000
amber-ffsb,n,ARG,NE,-0.5650000
amber-ffsb,n,ARG,HE,0.3592000
amber-ffsb,n,ARG,CZ,0.8281000
amber-ffsb,n,ARG,NH1,-0.8693000
amber-ffsb,n,ARG,HH11,0.4494000
amber-ffsb,n,ARG,HH12,0.4494000
amber-ffsb,n,ARG,NH2,-0.8693000
amber-ffsb,n,ARG,HH21,0.4494000
amber-ffsb,n,ARG,HH22,0.4494000
amber-ffsb,n,ARG,C,0.7214000
amber-ffsb,n,ARG,O,-0.6013000
amber-ffsb,c,ARG,N,-0.3481000
amber-ffsb,c,ARG,H,0.2764000
amber-ffsb,c,ARG,CA,-0.3068000
amber-ffsb,c,ARG,HA,0.1447000
amber-ffsb,c,ARG,CB,-0.0374000
amber-ffsb,c,ARG,HB2,0.0371000
amber-ffsb,c,ARG,HB3,0.0371000
amber-ffsb,c,ARG,CG,0.0744000
amber-ffsb,c,ARG,HG2,0.0185000
amber-ffsb,c,ARG,HG3,0.0185000
amber-ffsb,c,ARG,CD,0.1114000
amber-ffsb,c,ARG,HD2,0.0468000
amber-ffsb,c,ARG,HD3,0.0468000
amber-ffsb,c,ARG,NE,-0.5564000
amber-ffsb,c,ARG,HE,0.3479000
amber-ffsb,c,ARG,CZ,0.8368000
amber-ffsb,c,ARG,NH1,-0.8737000
amber-ffsb,c,ARG,HH11,0.4493000
amber-ffsb,c,ARG,HH12,0.4493000
amber-ffsb,c,ARG,NH2,-0.8737000
amber-ffsb,c,ARG,HH21,0.4493000
amber-ffsb,c,ARG,HH22,0.4493000
amber-ffsb,c,ARG,C,0.8557000
amber-ffsb,c,ARG,O,-0.8266000
amber-ffsb,c,ARG,OXT,-0.8266000
amber-ffsb,n-,ARG,N,-0.6612000
amber-ffsb,n-,ARG,H1,0.2083000
amber-ffsb,n-,ARG,H2,0.2083000
amber-ffsb,n-,ARG,CA,-0.0223000
amber-ffsb,n-,ARG,HA,0.1242000
amber-ffsb,n-,ARG,CB,0.0118000
amber-ffsb,n-,ARG,HB2,0.0226000
amber-ffsb,n-,ARG,HB3,0.0226000
amber-ffsb,n-,ARG,CG,0.0236000
amber-ffsb,n-,ARG,HG2,0.0309000
amber-ffsb,n-,ARG,HG3,0.0309000
amber-ffsb,n-,ARG,CD,0.0935000
amber-ffsb,n-,ARG,HD2,0.0527000
amber-ffsb,n-,ARG,HD3,0.0527000
amber-ffsb,n-,ARG,NE,-0.5650000
amber-ffsb,n-,ARG,HE,0.3592000
amber-ffsb,n-,ARG,CZ,0.8281000
amber-ffsb,n-,ARG,NH1,-0.8693000
amber-ffsb,n-,ARG,HH11,0.4494000
amber-ffsb,n-,ARG,HH12,0.4494000
amber-ffsb,n-,ARG,NH2,-0.8693000
amber-ffsb,n-,ARG,HH21,0.4494000
amber-ffsb,n-,ARG,HH22,0.4494000
amber-ffsb,n-,ARG,C,0.7214000
amber-ffsb,n-,ARG,O,-0.6013000
amber-ffsb,c+,ARG,N,-0.3481000
amber-ffsb,c+,ARG,H,0.2764000
amber-ffsb,c+,ARG,CA,-0.3068000
amber-ffsb,c+,ARG,HA,0.1447000
amber-ffsb,c+,ARG,CB,-0.0374000
amber-ffsb,c+,ARG,HB2,0.0371000
amber-ffsb,c+,ARG,HB3,0.0371000
amber-ffsb,c+,ARG,CG,0.0744000
amber-ffsb,c+,ARG,HG2,0.0185000
amber-ffsb,c+,ARG,HG3,0.0185000
amber-ffsb,c+,ARG,CD,0.1114000
amber-ffsb,c+,ARG,HD2,0.0468000
amber-ffsb,c+,ARG,HD3,0.0468000
amber-ffsb,c+,ARG,NE,-0.5564000
amber-ffsb,c+,ARG,HE,0.3479000
amber-ffsb,c+,ARG,CZ,0.8368000
amber-ffsb,c+,ARG,NH1,-0.8737000
amber-ffsb,c+,ARG,HH11,0.4493000
amber-ffsb,c+,ARG,HH12,0.4493000
amber-ffsb,c+,ARG,NH2,-0.8737000
amber-ffsb,c+,ARG,HH21,0.4493000
amber-ffsb,c+,ARG,HH22,0.4493000
amber-ffsb,c+,ARG,C,0.8557000
amber-ffsb,c+,ARG,O,-0.5591000
amber-ffsb,c+,ARG,OXT,-0.5591000
amber-ffsb,c+,ARG,HOXT,0.4650000
amber-ffsb,m,ARN,N,-0.4157000
amber-ffsb,m,ARN,H,0.2719000
amber-ffsb,m,ARN,CA,0.0044000
amber-ffsb,m,ARN,HA,0.1100000
amber-ffsb,m,ARN,CB,-0.0500000
amber-ffsb,m,ARN,HB2,0.0400000
amber-ffsb,m,ARN,HB3,0.0400000
amber-ffsb,m,ARN,CG,0.0500000
amber-ffsb,m,ARN,HG2,0.0400000
amber-ffsb,m,ARN,HG3,0.0400000
amber-ffsb,m,ARN,CD,0.1000000
amber-ffsb,m,ARN,HD2,0.0500000
amber-ffsb,m,ARN,HD3,0.0500000
amber-ffsb,m,ARN,NE,-0.5500000
amber-ffsb,m,ARN,HE,0.3400000
amber-ffsb,m,ARN,CZ,0.5500000
amber-ffsb,m,ARN,NH1,-1.1300000
amber-ffsb,m,ARN,HH11,0.3800000
amber-ffsb,m,ARN,HH12,0.3800000
amber-ffsb,m,ARN,NH2,-0.7000000
amber-ffsb,m,ARN,HH21,0.3700000
amber-ffsb,m,ARN,C,0.5973000
amber-ffsb,m,ARN,O,-0.5679000
amber-ffsb,n,ARN,N,0.1305000
amber-ffsb,n,ARN,H1,0.2083000
amber-ffsb,n,ARN,H2,0.2083000
amber-ffsb,n,ARN,H3,0.2083000
amber-ffsb,n,ARN,CA,-0.0223000
amber-ffsb,n,ARN,HA,0.1242000
amber-ffsb,n,ARN,CB,-0.0500000
amber-ffsb,n,ARN,HB2,0.0400000
amber-ffsb,n,ARN,HB3,0.0400000
amber-ffsb,n,ARN,CG,0.0500000
amber-ffsb,n,ARN,HG2,0.0400000
amber-ffsb,n,ARN,HG3,0.0400000
amber-ffsb,n,ARN,CD,0.1000000
amber-ffsb,n,ARN,HD2,0.0500000
amber-ffsb,n,ARN,HD3,0.0500000
amber-ffsb,n,ARN,NE,-0.5500000
amber-ffsb,n,ARN,HE,0.3400000
amber-ffsb,n,ARN,CZ,0.5500000
amber-ffsb,n,ARN,NH1,-1.1074000
amber-ffsb,n,ARN,HH11,0.3800000
amber-ffsb,n,ARN,HH12,0.3800000
amber-ffsb,n,ARN,NH2,-0.7000000
amber-ffsb,n,ARN,HH21,0.3700000
amber-ffsb,n,ARN,C,0.7214000
amber-ffsb,n,ARN,O,-0.6013000
amber-ffsb,c,ARN,N,-0.3481000
amber-ffsb,c,ARN,H,0.2764000
amber-ffsb,c,ARN,CA,-0.3068000
amber-ffsb,c,ARN,HA,0.1447000
amber-ffsb,c,ARN,CB,-0.0500000
amber-ffsb,c,ARN,HB2,0.0400000
amber-ffsb,c,ARN,HB3,0.0400000
amber-ffsb,c,ARN,CG,0.0500000
amber-ffsb,c,ARN,HG2,0.0400000
amber-ffsb,c,ARN,HG3,0.0400000
amber-ffsb,c,ARN,CD,0.1000000
amber-ffsb,c,ARN,HD2,0.0500000
amber-ffsb,c,ARN,HD3,0.0500000
amber-ffsb,c,ARN,NE,-0.5500000
amber-ffsb,c,ARN,HE,0.3400000
amber-ffsb,c,ARN,CZ,0.5500000
amber-ffsb,c,ARN,NH1,-1.0987000
amber-ffsb,c,ARN,HH11,0.3800000
amber-ffsb,c,ARN,HH12,0.3800000
amber-ffsb,c,ARN,NH2,-0.7000000
amber-ffsb,c,ARN,HH21,0.3700000
amber-ffsb,c,ARN,C,0.8557000
amber-ffsb,c,ARN,O,-0.8266000
amber-ffsb,c,ARN,OXT,-0.8266000
amber-ffsb,n-,ARN,N,-0.6612000
amber-ffsb,n-,ARN,H1,0.2083000
amber-ffsb,n-,ARN,H2,0.2083000
amber-ffsb,n-,ARN,CA,-0.0223000
amber-ffsb,n-,ARN,HA,0.1242000
amber-ffsb,n-,ARN,CB,-0.0500000
amber-ffsb,n-,ARN,HB2,0.0400000
amber-ffsb,n-,ARN,HB3,0.0400000
amber-ffsb,n-,ARN,CG,0.0500000
amber-ffsb,n-,ARN,HG2,0.0400000
amber-ffsb,n-,ARN,HG3,0.0400000
amber-ffsb,n-,ARN,CD,0.1000000
amber-ffsb,n-,ARN,HD2,0.0500000
amber-ffsb,n-,ARN,HD3,0.0500000
amber-ffsb,n-,ARN,NE,-0.5500000
amber-ffsb,n-,ARN,HE,0.3400000
amber-ffsb,n-,ARN,CZ,0.5500000
amber-ffsb,n-,ARN,NH1,-1.1074000
amber-ffsb,n-,ARN,HH11,0.3800000
amber-ffsb,n-,ARN,HH12,0.3800000
amber-ffsb,n-,ARN,NH2,-0.7000000
amber-ffsb,n-,ARN,HH21,0.3700000
amber-ffsb,n-,ARN,C,0.7214000
amber-ffsb,n-,ARN,O,-0.6013000
amber-ffsb,c+,ARN,N,-0.3481000
amber-ffsb,c+,ARN,H,0.2764000
amber-ffsb,c+,ARN,CA,-0.3068000
amber-ffsb,c+,ARN,HA,0.1447000
amber-ffsb,c+,ARN,CB,-0.0500000
amber-ffsb,c+,ARN,HB2,0.0400000
amber-ffsb,c+,ARN,HB3,0.0400000
amber-ffsb,c+,ARN,CG,0.0500000
amber-ffsb,c+,ARN,HG2,0.0400000
amber-ffsb,c+,ARN,HG3,0.0400000
amber-ffsb,c+,ARN,CD,0.1000000
amber-ffsb,c+,ARN,HD2,0.0500000
amber-ffsb,c+,ARN,HD3,0.0500000
amber-ffsb,c+,ARN,NE,-0.5500000
amber-ffsb,c+,ARN,HE,0.3400000
amber-ffsb,c+,ARN,CZ,0.5500000
amber-ffsb,c+,ARN,NH1,-1.0987000
amber-ffsb,c+,ARN,HH11,0.3800000
amber-ffsb,c+,ARN,HH12,0.3800000
amber-ffsb,c+,ARN,NH2,-0.7000000
amber-ffsb,c+,ARN,HH21,0.3700000
amber-ffsb,c+,ARN,C,0.8557000
amber-ffsb,c+,ARN,O,-0.5591000
amber-ffsb,c+,ARN,OXT,-0.5591000
amber-ffsb,c+,ARN,HOXT,0.4650000
amber-ffsb,m,ASN,N,-0.4157000
amber-ffsb,m,ASN,H,0.2719000
amber-ffsb,m,ASN,CA,0.0143000
amber-ffsb,m,ASN,HA,0.1048000
amber-ffsb,m,ASN,CB,-0.2041000
amber-ffsb,m,ASN,HB2,0.0797000
amber-ffsb,m,ASN,HB3,0.0797000
amber-ffsb,m,ASN,CG,0.7130000
amber-ffsb,m,ASN,OD1,-0.5931000
amber-ffsb,m,ASN,ND2,-0.9191000
amber-ffsb,m,ASN,HD21,0.4196000
amber-ffsb,m,ASN,HD22,0.4196000
amber-ffsb,m,ASN,C,0.5973000
amber-ffsb,m,ASN,O,-0.5679000
amber-ffsb,n,ASN,N,0.1801000
amber-ffsb,n,ASN,H1,0.1921000
amber-ffsb,n,ASN,H2,0.1921000
amber-ffsb,n,ASN,H3,0.1921000
amber-ffsb,n,ASN,CA,0.0368000
amber-ffsb,n,ASN,HA,0.1231000
amber-ffsb,n,ASN,CB,-0.0283000
amber-ffsb,n,ASN,HB2,0.0515000
amber-ffsb,n,ASN,HB3,0.0515000
amber-ffsb,n,ASN,CG,0.5833000
amber-ffsb,n,ASN,OD1,-0.5744000
amber-ffsb,n,ASN,ND2,-0.8634000
amber-ffsb,n,ASN,HD21,0.4097000
amber-ffsb,n,ASN,HD22,0.4097000
amber-ffsb,n,ASN,C,0.6163000
amber-ffsb,n,ASN,O,-0.5722000
amber-ffsb,c,ASN,N,-0.3821000
amber-ffsb,c,ASN,H,0.2681000
amber-ffsb,c,ASN,CA,-0.2080000
amber-ffsb,c,ASN,HA,0.1358000
amber-ffsb,c,ASN,CB,-0.2299000
amber-ffsb,c,ASN,HB2,0.1023000
amber-ffsb,c,ASN,HB3,0.1023000
amber-ffsb,c,ASN,CG,0.7153000
amber-ffsb,c,ASN,OD1,-0.6010000
amber-ffsb,c,ASN,ND2,-0.9084000
amber-ffsb,c,ASN,HD21,0.4150000
amber-ffsb,c,ASN,HD22,0.4150000
amber-ffsb,c,ASN,C,0.8050000
amber-ffsb,c,ASN,O,-0.8147000
amber-ffsb,c,ASN,OXT,-0.8147000
amber-ffsb,n-,ASN,N,-0.6278000
amber-ffsb,n-,ASN,H1,0.1921000
amber-ffsb,n-,ASN,H2,0.1921000
amber-ffsb,n-,ASN,CA,0.0368000
amber-ffsb,n-,ASN,HA,0.1231000
amber-ffsb,n-,ASN,CB,-0.0283000
amber-ffsb,n-,ASN,HB2,0.0515000
amber-ffsb,n-,ASN,HB3,0.0515000
amber-ffsb,n-,ASN,CG,0.5833000
amber-ffsb,n-,ASN,OD1,-0.5744000
amber-ffsb,n-,ASN,ND2,-0.8634000
amber-ffsb,n-,ASN,HD21,0.4097000
amber-ffsb,n-,ASN,HD22,0.4097000
amber-ffsb,n-,ASN,C,0.6163000
amber-ffsb,n-,ASN,O,-0.5722000
amber-ffsb,c+,ASN,N,-0.3821000
amber-ffsb,c+,ASN,H,0.2681000
amber-ffsb,c+,ASN,CA,-0.2080000
amber-ffsb,c+,ASN,HA,0.1358000
amber-ffsb,c+,ASN,CB,-0.2299000
amber-ffsb,c+,ASN,HB2,0.1023000
amber-ffsb,c+,ASN,HB3,0.1023000
amber-ffsb,c+,ASN,CG,0.7153000
amber-ffsb,c+,ASN,OD1,-0.6010000
amber-ffsb,c+,ASN,ND2,-0.9084000
amber-ffsb,c+,ASN,HD21,0.4150000
amber-ffsb,c+,ASN,HD22,0.4150000
amber-ffsb,c+,ASN,C,0.8050000
amber-ffsb,c+,ASN,O,-0.5472000
amber-ffsb,c+,ASN,OXT,-0.5472000
amber-ffsb,c+,ASN,HOXT,0.4650000
amber-ffsb,m,ASP,N,-0.5163000
amber-ffsb,m,ASP,H,0.2936000
amber-ffsb,m,ASP,CA,0.0381000
amber-ffsb,m,ASP,HA,0.0880000
amber-ffsb,m,ASP,CB,-0.0303000
amber-ffsb,m,ASP,HB2,-0.0122000
amber-ffsb,m,ASP,HB3,-0.0122000
amber-ffsb,m,ASP,CG,0.7994000
amber-ffsb,m,ASP,OD1,-0.8014000
amber-ffsb,m,ASP,OD2,-0.8014000
amber-ffsb,m,ASP,C,0.5366000
amber-ffsb,m,ASP,O,-0.5819000
amber-ffsb,n,ASP,N,0.0782000
amber-ffsb,n,ASP,H1,0.2200000
amber-ffsb,n,ASP,H2,0.2200000
amber-ffsb,n,ASP,H3,0.2200000
amber-ffsb,n,ASP,CA,0.0292000
amber-ffsb,n,ASP,HA,0.1141000
amber-ffsb,n,ASP,CB,-0.0235000
amber-ffsb,n,ASP,HB2,-0.0169000
amber-ffsb,n,ASP,HB3,-0.0169000
amber-ffsb,n,ASP,CG,0.8194000
amber-ffsb,n,ASP,OD1,-0.8084000
amber-ffsb,n,ASP,OD2,-0.8084000
amber-ffsb,n,ASP,C,0.5621000
amber-ffsb,n,ASP,O,-0.5889000
amber-ffsb,c,ASP,N,-0.5192000
amber-ffsb,c,ASP,H,0.3055000
amber-ffsb,c,ASP,CA,-0.1817000
amber-ffsb,c,ASP,HA,0.1046000
amber-ffsb,c,ASP,CB,-0.0677000
amber-ffsb,c,ASP,HB2,-0.0212000
amber-ffsb,c,ASP,HB3,-0.0212000
amber-ffsb,c,ASP,CG,0.8851000
amber-ffsb,c,ASP,OD1,-0.8162000
amber-ffsb,c,ASP,OD2,-0.8162000
amber-ffsb,c,ASP,C,0.7256000
amber-ffsb,c,ASP,O,-0.7887000
amber-ffsb,c,ASP,OXT,-0.7887000
amber-ffsb,n-,ASP,N,-0.7018000
amber-ffsb,n-,ASP,H1,0.2200000
amber-ffsb,n-,ASP,H2,0.2200000
amber-ffsb,n-,ASP,CA,0.0292000
amber-ffsb,n-,ASP,HA,0.1141000
amber-ffsb,n-,ASP,CB,-0.0235000
amber-ffsb,n-,ASP,HB2,-0.0169000
amber-ffsb,n-,ASP,HB3,-0.0169000
amber-ffsb,n-,ASP,CG,0.8194000
amber-ffsb,n-,ASP,OD1,-0.8084000
amber-ffsb,n-,ASP,OD2,-0.8084000
amber-ffsb,n-,ASP,C,0.5621000
amber-ffsb,n-,ASP,O,-0.5889000
amber-ffsb,c+,ASP,N,-0.5192000
amber-ffsb,c+,ASP,H,0.3055000
amber-ffsb,c+,ASP,CA,-0.1817000
amber-ffsb,c+,ASP,HA,0.1046000
amber-ffsb,c+,ASP,CB,-0.0677000
amber-ffsb,c+,ASP,HB2,-0.0212000
amber-ffsb,c+,ASP,HB3,-0.0212000
amber-ffsb,c+,ASP,CG,0.8851000
amber-ffsb,c+,ASP,OD1,-0.8162000
amber-ffsb,c+,ASP,OD2,-0.8162000
amber-ffsb,c+,ASP,C,0.7256000
amber-ffsb,c+,ASP,O,-0.5212000
amber-ffsb,c+,ASP,OXT,-0.5212000
amber-ffsb,c+,ASP,HOXT,0.4650000
amber-ffsb,m,ASH,N,-0.4157000
amber-ffsb,m,ASH,H,0.2719000
amber-ffsb,m,ASH,CA,0.0341000
amber-ffsb,m,ASH,HA,0.0864000
amber-ffsb,m,ASH,CB,-0.0316000
amber-ffsb,m,ASH,HB2,0.0488000
amber-ffsb,m,ASH,HB3,0.0488000
amber-ffsb,m,ASH,CG,0.6462000
amber-ffsb,m,ASH,OD1,-0.5554000
amber-ffsb,m,ASH,OD2,-0.6376000
amber-ffsb,m,ASH,HD2,0.4747000
amber-ffsb,m,ASH,C,0.5973000
amber-ffsb,m,ASH,O,-0.5679000
amber-ffsb,n,ASH,N,0.0782000
amber-ffsb,n,ASH,H1,0.2200000
amber-ffsb,n,ASH,H2,0.2200000
amber-ffsb,n,ASH,H3,0.2200000
amber-ffsb,n,ASH,CA,0.0292000
amber-ffsb,n,ASH,HA,0.1141000
amber-ffsb,n,ASH,CB,-0.0253099
amber-ffsb,n,ASH,HB2,0.0680279
amber-ffsb,n,ASH,HB3,0.0680279
amber-ffsb,n,ASH,CG,0.6061056
amber-ffsb,n,ASH,OD1,-0.4659038
amber-ffsb,n,ASH,OD2,-0.5803477
amber-ffsb,n,ASH,HD2,0.4747000
amber-ffsb,n,ASH,C,0.5621000
amber-ffsb,n,ASH,O,-0.5889000
amber-ffsb,c,ASH,N,-0.5192000
amber-ffsb,c,ASH,H,0.3055000
amber-ffsb,c,ASH,CA,-0.1817000
amber-ffsb,c,ASH,HA,0.1046000
amber-ffsb,c,ASH,CB,-0.0695099
amber-ffsb,c,ASH,HB2,0.0637279
amber-ffsb,c,ASH,HB3,0.0637279
amber-ffsb,c,ASH,CG,0.6718056
amber-ffsb,c,ASH,OD1,-0.4737038
amber-ffsb,c,ASH,OD2,-0.5881477
amber-ffsb,c,ASH,HD2,0.4747000
amber-ffsb,c,ASH,C,0.7256000
amber-ffsb,c,ASH,O,-0.7887000
amber-ffsb,c,ASH,OXT,-0.7887000
amber-ffsb,n-,ASH,N,-0.7018000
amber-ffsb,n-,ASH,H1,0.2200000
amber-ffsb,n-,ASH,H2,0.2200000
amber-ffsb,n-,ASH,CA,0.0292000
amber-ffsb,n-,ASH,HA,0.1141000
amber-ffsb,n-,ASH,CB,-0.0253099
amber-ffsb,n-,ASH,HB2,0.0680279
amber-ffsb,n-,ASH,HB3,0.0680279
amber-ffsb,n-,ASH,CG,0.6061056
amber-ffsb,n-,ASH,OD1,-0.4659038
amber-ffsb,n-,ASH,OD2,-0.5803477
amber-ffsb,n-,ASH,HD2,0.4747000
amber-ffsb,n-,ASH,C,0.5621000
amber-ffsb,n-,ASH,O,-0.5889000
amber-ffsb,c+,ASH,N,-0.5192000
amber-ffsb,c+,ASH,H,0.3055000
amber-ffsb,c+,ASH,CA,-0.1817000
amber-ffsb,c+,ASH,HA,0.1046000
amber-ffsb,c+,ASH,CB,-0.0695099
amber-ffsb,c+,ASH,HB2,0.0637279
amber-ffsb,c+,ASH,HB3,0.0637279
amber-ffsb,c+,ASH,CG,0.6718056
amber-ffsb,c+,ASH,OD1,-0.4737038
amber-ffsb,c+,ASH,OD2,-0.5881477
amber-ffsb,c+,ASH,HD2,0.4747000
amber-ffsb,c+,ASH,C,0.7256000
amber-ffsb,c+,ASH,O,-0.5212000
amber-ffsb,c+,ASH,OXT,-0.5212000
amber-ffsb,c+,ASH,HOXT,0.4650000
amber-ffsb,m,CYS,N,-0.4157000
amber-ffsb,m,CYS,H,0.2719000
amber-ffsb,m,CYS,CA,0.0213000
amber-ffsb,m,CYS,HA,0.1124000
amber-ffsb,m,CYS,CB,-0.1231000
amber-ffsb,m,CYS,HB2,0.1112000
amber-ffsb,m,CYS,HB3,0.1112000
amber-ffsb,m,CYS,SG,-0.3119000
amber-ffsb,m,CYS,HG,0.1933000
amber-ffsb,m,CYS,C,0.5973000
amber-ffsb,m,CYS,O,-0.5679000
amber-ffsb,n,CYS,N,0.1325000
amber-ffsb,n,CYS,H1,0.2023000
amber-ffsb,n,CYS,H2,0.2023000
amber-ffsb,n,CYS,H3,0.2023000
amber-ffsb,n,CYS,CA,0.0927000
amber-ffsb,n,CYS,HA,0.1411000
amber-ffsb,n,CYS,CB,-0.1195000
amber-ffsb,n,CYS,HB2,0.1188000
amber-ffsb,n,CYS,HB3,0.1188000
amber-ffsb,n,CYS,SG,-0.3298000
amber-ffsb,n,CYS,HG,0.1975000
amber-ffsb,n,CYS,C,0.6123000
amber-ffsb,n,CYS,O,-0.5713000
amber-ffsb,c,CYS,N,-0.3821000
amber-ffsb,c,CYS,H,0.2681000
amber-ffsb,c,CYS,CA,-0.1635000
amber-ffsb,c,CYS,HA,0.1396000
amber-ffsb,c,CYS,CB,-0.1996000
amber-ffsb,c,CYS,HB2,0.1437000
amber-ffsb,c,CYS,HB3,0.1437000
amber-ffsb,c,CYS,SG,-0.3102000
amber-ffsb,c,CYS,HG,0.2068000
amber-ffsb,c,CYS,C,0.7497000
amber-ffsb,c,CYS,O,-0.7981000
amber-ffsb,c,CYS,OXT,-0.7981000
amber-ffsb,n-,CYS,N,-0.6652000
amber-ffsb,n-,CYS,H1,0.2023000
amber-ffsb,n-,CYS,H2,0.2023000
amber-ffsb,n-,CYS,CA,0.0927000
amber-ffsb,n-,CYS,HA,0.1411000
amber-ffsb,n-,CYS,CB,-0.1195000
amber-ffsb,n-,CYS,HB2,0.1188000
amber-ffsb,n-,CYS,HB3,0.1188000
amber-ffsb,n-,CYS,SG,-0.3298000
amber-ffsb,n-,CYS,HG,0.1975000
amber-ffsb,n-,CYS,C,0.6123000
amber-ffsb,n-,CYS,O,-0.5713000
amber-ffsb,c+,CYS,N,-0.3821000
amber-ffsb,c+,CYS,H,0.2681000
amber-ffsb,c+,CYS,CA,-0.1635000
amber-ffsb,c+,CYS,HA,0.1396000
amber-ffsb,c+,CYS,CB,-0.1996000
amber-ffsb,c+,CYS,HB2,0.1437000
amber-ffsb,c+,CYS,HB3,0.1437000
amber-ffsb,c+,CYS,SG,-0.3102000
amber-ffsb,c+,CYS,HG,0.2068000
amber-ffsb,c+,CYS,C,0.7497000
amber-ffsb,c+,CYS,O,-0.5306000
amber-ffsb,c+,CYS,OXT,-0.5306000
amber-ffsb,c+,CYS,HOXT,0.4650000
amber-ffsb,m,CYM,N,-0.4157000
amber-ffsb,m,CYM,H,0.2719000
amber-ffsb,m,CYM,CA,-0.0351000
amber-ffsb,m,CYM,HA,0.0508000
amber-ffsb,m,CYM,CB,-0.2413000
amber-ffsb,m,CYM,HB2,0.1122000
amber-ffsb,m,CYM,HB3,0.1122000
amber-ffsb,m,CYM,SG,-0.8844000
amber-ffsb,m,CYM,C,0.5973000
amber-ffsb,m,CYM,O,-0.5679000
amber-ffsb,n,CYM,N,0.1325000
amber-ffsb,n,CYM,H1,0.2023000
amber-ffsb,n,CYM,H2,0.2023000
amber-ffsb,n,CYM,H3,0.2023000
amber-ffsb,n,CYM,CA,0.0927000
amber-ffsb,n,CYM,HA,0.1411000
amber-ffsb,n,CYM,CB,-0.2413000
amber-ffsb,n,CYM,HB2,0.1122000
amber-ffsb,n,CYM,HB3,0.1122000
amber-ffsb,n,CYM,SG,-0.9973000
amber-ffsb,n,CYM,C,0.6123000
amber-ffsb,n,CYM,O,-0.5713000
amber-ffsb,c,CYM,N,-0.3821000
amber-ffsb,c,CYM,H,0.2681000
amber-ffsb,c,CYM,CA,-0.1635000
amber-ffsb,c,CYM,HA,0.1396000
amber-ffsb,c,CYM,CB,-0.2413000
amber-ffsb,c,CYM,HB2,0.1122000
amber-ffsb,c,CYM,HB3,0.1122000
amber-ffsb,c,CYM,SG,-0.9987000
amber-ffsb,c,CYM,C,0.7497000
amber-ffsb,c,CYM,O,-0.7981000
amber-ffsb,c,CYM,OXT,-0.7981000
amber-ffsb,n-,CYM,N,-0.6652000
amber-ffsb,n-,CYM,H1,0.2023000
amber-ffsb,n-,CYM,H2,0.2023000
amber-ffsb,n-,CYM,CA,0.0927000
amber-ffsb,n-,CYM,HA,0.1411000
amber-ffsb,n-,CYM,CB,-0.2413000
amber-ffsb,n-,CYM,HB2,0.1122000
amber-ffsb,n-,CYM,HB3,0.1122000
amber-ffsb,n-,CYM,SG,-0.9973000
amber-ffsb,n-,CYM,C,0.6123000
amber-ffsb,n-,CYM,O,-0.5713000
amber-ffsb,c+,CYM,N,-0.3821000
amber-ffsb,c+,CYM,H,0.2681000
amber-ffsb,c+,CYM,CA,-0.1635000
amber-ffsb,c+,CYM,HA,0.1396000
amber-ffsb,c+,CYM,CB,-0.2413000
amber-ffsb,c+,CYM,HB2,0.1122000
amber-ffsb,c+,CYM,HB3,0.1122000
amber-ffsb,c+,CYM,SG,-0.9987000
amber-ffsb,c+,CYM,C,0.7497000
amber-ffsb,c+,CYM,O,-0.5306000
amber-ffsb,c+,CYM,OXT,-0.5306000
amber-ffsb,c+,CYM,HOXT,0.4650000
amber-ffsb,m,CYX,N,-0.4157000
amber-ffsb,m,CYX,H,0.2719000
amber-ffsb,m,CYX,CA,0.0429000
amber-ffsb,m,CYX,HA,0.0766000
amber-ffsb,m,CYX,CB,-0.0790000
amber-ffsb,m,CYX,HB2,0.0910000
amber-ffsb,m,CYX,HB3,0.0910000
amber-ffsb,m,CYX,SG,-0.1081000
amber-ffsb,m,CYX,C,0.5973000
amber-ffsb,m,CYX,O,-0.5679000
amber-ffsb,n,CYX,N,0.2069000
amber-ffsb,n,CYX,H1,0.1815000
amber-ffsb,n,CYX,H2,0.1815000
amber-ffsb,n,CYX,H3,0.1815000
amber-ffsb,n,CYX,CA,0.1055000
amber-ffsb,n,CYX,HA,0.0922000
amber-ffsb,n,CYX,CB,-0.0277000
amber-ffsb,n,CYX,HB2,0.0680000
amber-ffsb,n,CYX,HB3,0.0680000
amber-ffsb,n,CYX,SG,-0.0984000
amber-ffsb,n,CYX,C,0.6123000
amber-ffsb,n,CYX,O,-0.5713000
amber-ffsb,c,CYX,N,-0.3821000
amber-ffsb,c,CYX,H,0.2681000
amber-ffsb,c,CYX,CA,-0.1318000
amber-ffsb,c,CYX,HA,0.0938000
amber-ffsb,c,CYX,CB,-0.1943000
amber-ffsb,c,CYX,HB2,0.1228000
amber-ffsb,c,CYX,HB3,0.1228000
amber-ffsb,c,CYX,SG,-0.0529000
amber-ffsb,c,CYX,C,0.7618000
amber-ffsb,c,CYX,O,-0.8041000
amber-ffsb,c,CYX,OXT,-0.8041000
amber-ffsb,n-,CYX,N,-0.6116000
amber-ffsb,n-,CYX,H1,0.1815000
amber-ffsb,n-,CYX,H2,0.1815000
amber-ffsb,n-,CYX,CA,0.1055000
amber-ffsb,n-,CYX,HA,0.0922000
amber-ffsb,n-,CYX,CB,-0.0277000
amber-ffsb,n-,CYX,HB2,0.0680000
amber-ffsb,n-,CYX,HB3,0.0680000
amber-ffsb,n-,CYX,SG,-0.0984000
amber-ffsb,n-,CYX,C,0.6123000
amber-ffsb,n-,CYX,O,-0.5713000
amber-ffsb,c+,CYX,N,-0.3821000
amber-ffsb,c+,CYX,H,0.2681000
amber-ffsb,c+,CYX,CA,-0.1318000
amber-ffsb,c+,CYX,HA,0.0938000
amber-ffsb,c+,CYX,CB,-0.1943000
amber-ffsb,c+,CYX,HB2,0.1228000
amber-ffsb,c+,CYX,HB3,0.1228000
amber-ffsb,c+,CYX,SG,-0.0529000
amber-ffsb,c+,CYX,C,0.7618000
amber-ffsb,c+,CYX,O,-0.5366000
amber-ffsb,c+,CYX,OXT,-0.5366000
amber-ffsb,c+,CYX,HOXT,0.4650000
amber-ffsb,m,GLN,N,-0.4157000
amber-ffsb,m,GLN,H,0.2719000
amber-ffsb,m,GLN,CA,-0.0031000
amber-ffsb,m,GLN,HA,0.0850000
amber-ffsb,m,GLN,CB,-0.0036000
amber-ffsb,m,GLN,HB2,0.0171000
amber-ffsb,m,GLN,HB3,0.0171000
amber-ffsb,m,GLN,CG,-0.0645000
amber-ffsb,m,GLN,HG2,0.0352000
amber-ffsb,m,GLN,HG3,0.0352000
amber-ffsb,m,GLN,CD,0.6951000
amber-ffsb,m,GLN,OE1,-0.6086000
amber-ffsb,m,GLN,NE2,-0.9407000
amber-ffsb,m,GLN,HE21,0.4251000
amber-ffsb,m,GLN,HE22,0.4251000
amber-ffsb,m,GLN,C,0.5973000
amber-ffsb,m,GLN,O,-0.5679000
amber-ffsb,n,GLN,N,0.1493000
amber-ffsb,n,GLN,H1,0.1996000
amber-ffsb,n,GLN,H2,0.1996000
amber-ffsb,n,GLN,H3,0.1996000
amber-ffsb,n,GLN,CA,0.0536000
amber-ffsb,n,GLN,HA,0.1015000
amber-ffsb,n,GLN,CB,0.0651000
amber-ffsb,n,GLN,HB2,0.0050000
amber-ffsb,n,GLN,HB3,0.0050000
amber-ffsb,n,GLN,CG,-0.0903000
amber-ffsb,n,GLN,HG2,0.0331000
amber-ffsb,n,GLN,HG3,0.0331000
amber-ffsb,n,GLN,CD,0.7354000
amber-ffsb,n,GLN,OE1,-0.6133000
amber-ffsb,n,GLN,NE2,-1.0031000
amber-ffsb,n,GLN,HE21,0.4429000
amber-ffsb,n,GLN,HE22,0.4429000
amber-ffsb,n,GLN,C,0.6123000
amber-ffsb,n,GLN,O,-0.5713000
amber-ffsb,c,GLN,N,-0.3821000
amber-ffsb,c,GLN,H,0.2681000
amber-ffsb,c,GLN,CA,-0.2248000
amber-ffsb,c,GLN,HA,0.1232000
amber-ffsb,c,GLN,CB,-0.0664000
amber-ffsb,c,GLN,HB2,0.0452000
amber-ffsb,c,GLN,HB3,0.0452000
amber-ffsb,c,GLN,CG,-0.0210000
amber-ffsb,c,GLN,HG2,0.0203000
amber-ffsb,c,GLN,HG3,0.0203000
amber-ffsb,c,GLN,CD,0.7093000
amber-ffsb,c,GLN,OE1,-0.6098000
amber-ffsb,c,GLN,NE2,-0.9574000
amber-ffsb,c,GLN,HE21,0.4304000
amber-ffsb,c,GLN,HE22,0.4304000
amber-ffsb,c,GLN,C,0.7775000
amber-ffsb,c,GLN,O,-0.8042000
amber-ffsb,c,GLN,OXT,-0.8042000
amber-ffsb,n-,GLN,N,-0.6511000
amber-ffsb,n-,GLN,H1,0.1996000
amber-ffsb,n-,GLN,H2,0.1996000
amber-ffsb,n-,GLN,CA,0.0536000
amber-ffsb,n-,GLN,HA,0.1015000
amber-ffsb,n-,GLN,CB,0.0651000
amber-ffsb,n-,GLN,HB2,0.0050000
amber-ffsb,n-,GLN,HB3,0.0050000
amber-ffsb,n-,GLN,CG,-0.0903000
amber-ffsb,n-,GLN,HG2,0.0331000
amber-ffsb,n-,GLN,HG3,0.0331000
amber-ffsb,n-,GLN,CD,0.7354000
amber-ffsb,n-,GLN,OE1,-0.6133000
amber-ffsb,n-,GLN,NE2,-1.0031000
amber-ffsb,n-,GLN,HE21,0.4429000
amber-ffsb,n-,GLN,HE22,0.4429000
amber-ffsb,n-,GLN,C,0.6123000
amber-ffsb,n-,GLN,O,-0.5713000
amber-ffsb,c+,GLN,N,-0.3821000
amber-ffsb,c+,GLN,H,0.2681000
amber-ffsb,c+,GLN,CA,-0.2248000
amber-ffsb,c+,GLN,HA,0.1232000
amber-ffsb,c+,GLN,CB,-0.0664000
amber-ffsb,c+,GLN,HB2,0.0452000
amber-ffsb,c+,GLN,HB3,0.0452000
amber-ffsb,c+,GLN,CG,-0.0210000
amber-ffsb,c+,GLN,HG2,0.0203000
amber-ffsb,c+,GLN,HG3,0.0203000
amber-ffsb,c+,GLN,CD,0.7093000
amber-ffsb,c+,GLN,OE1,-0.6098000
amber-ffsb,c+,GLN,NE2,-0.9574000
amber-ffsb,c+,GLN,HE21,0.4304000
amber-ffsb,c+,GLN,HE22,0.4304000
amber-ffsb,c+,GLN,C,0.7775000
amber-ffsb,c+,GLN,O,-0.5367000
amber-ffsb,c+,GLN,OXT,-0.5367000
amber-ffsb,c+,GLN,HOXT,0.4650000
amber-ffsb,m,GLU,N,-0.5163000
amber-ffsb,m,GLU,H,0.2936000
amber-ffsb,m,GLU,CA,0.0397000
amber-ffsb,m,GLU,HA,0.1105000
amber-ffsb,m,GLU,CB,0.0560000
amber-ffsb,m,GLU,HB2,-0.0173000
amber-ffsb,m,GLU,HB3,-0.0173000
amber-ffsb,m,GLU,CG,0.0136000
amber-ffsb,m,GLU,HG2,-0.0425000
amber-ffsb,m,GLU,HG3,-0.0425000
amber-ffsb,m,GLU,CD,0.8054000
amber-ffsb,m,GLU,OE1,-0.8188000
amber-ffsb,m,GLU,OE2,-0.8188000
amber-ffsb,m,GLU,C,0.5366000
amber-ffsb,m,GLU,O,-0.5819000
amber-ffsb,n,GLU,N,0.0017000
amber-ffsb,n,GLU,H1,0.2391000
amber-ffsb,n,GLU,H2,0.2391000
amber-ffsb,n,GLU,H3,0.2391000
amber-ffsb,n,GLU,CA,0.0588000
amber-ffsb,n,GLU,HA,0.1202000
amber-ffsb,n,GLU,CB,0.0909000
amber-ffsb,n,GLU,HB2,-0.0232000
amber-ffsb,n,GLU,HB3,-0.0232000
amber-ffsb,n,GLU,CG,-0.0236000
amber-ffsb,n,GLU,HG2,-0.0315000
amber-ffsb,n,GLU,HG3,-0.0315000
amber-ffsb,n,GLU,CD,0.8087000
amber-ffsb,n,GLU,OE1,-0.8189000
amber-ffsb,n,GLU,OE2,-0.8189000
amber-ffsb,n,GLU,C,0.5621000
amber-ffsb,n,GLU,O,-0.5889000
amber-ffsb,c,GLU,N,-0.5192000
amber-ffsb,c,GLU,H,0.3055000
amber-ffsb,c,GLU,CA,-0.2059000
amber-ffsb,c,GLU,HA,0.1399000
amber-ffsb,c,GLU,CB,0.0071000
amber-ffsb,c,GLU,HB2,-0.0078000
amber-ffsb,c,GLU,HB3,-0.0078000
amber-ffsb,c,GLU,CG,0.0675000
amber-ffsb,c,GLU,HG2,-0.0548000
amber-ffsb,c,GLU,HG3,-0.0548000
amber-ffsb,c,GLU,CD,0.8183000
amber-ffsb,c,GLU,OE1,-0.8220000
amber-ffsb,c,GLU,OE2,-0.8220000
amber-ffsb,c,GLU,C,0.7420000
amber-ffsb,c,GLU,O,-0.7930000
amber-ffsb,c,GLU,OXT,-0.7930000
amber-ffsb,n-,GLU,N,-0.7592000
amber-ffsb,n-,GLU,H1,0.2391000
amber-ffsb,n-,GLU,H2,0.2391000
amber-ffsb,n-,GLU,CA,0.0588000
amber-ffsb,n-,GLU,HA,0.1202000
amber-ffsb,n-,GLU,CB,0.0909000
amber-ffsb,n-,GLU,HB2,-0.0232000
amber-ffsb,n-,GLU,HB3,-0.0232000
amber-ffsb,n-,GLU,CG,-0.0236000
amber-ffsb,n-,GLU,HG2,-0.0315000
amber-ffsb,n-,GLU,HG3,-0.0315000
amber-ffsb,n-,GLU,CD,0.8087000
amber-ffsb,n-,GLU,OE1,-0.8189000
amber-ffsb,n-,GLU,OE2,-0.8189000
amber-ffsb,n-,GLU,C,0.5621000
amber-ffsb,n-,GLU,O,-0.5889000
amber-ffsb,c+,GLU,N,-0.5192000
amber-ffsb,c+,GLU,H,0.3055000
amber-ffsb,c+,GLU,CA,-0.2059000
amber-ffsb,c+,GLU,HA,0.1399000
amber-ffsb,c+,GLU,CB,0.0071000
amber-ffsb,c+,GLU,HB2,-0.0078000
amber-ffsb,c+,GLU,HB3,-0.0078000
amber-ffsb,c+,GLU,CG,0.0675000
amber-ffsb,c+,GLU,HG2,-0.0548000
amber-ffsb,c+,GLU,HG3,-0.0548000
amber-ffsb,c+,GLU,CD,0.8183000
amber-ffsb,c+,GLU,OE1,-0.8220000
amber-ffsb,c+,GLU,OE2,-0.8220000
amber-ffsb,c+,GLU,C,0.7420000
amber-ffsb,c+,GLU,O,-0.5255000
amber-ffsb,c+,GLU,OXT,-0.5255000
amber-ffsb,c+,GLU,HOXT,0.4650000
amber-ffsb,m,GLH,N,-0.4157000
amber-ffsb,m,GLH,H,0.2719000
amber-ffsb,m,GLH,CA,0.0145000
amber-ffsb,m,GLH,HA,0.0779000
amber-ffsb,m,GLH,CB,-0.0071000
amber-ffsb,m,GLH,HB2,0.0256000
amber-ffsb,m,GLH,HB3,0.0256000
amber-ffsb,m,GLH,CG,-0.0174000
amber-ffsb,m,GLH,HG2,0.0430000
amber-ffsb,m,GLH,HG3,0.0430000
amber-ffsb,m,GLH,CD,0.6801000
amber-ffsb,m,GLH,OE1,-0.5838000
amber-ffsb,m,GLH,OE2,-0.6511000
amber-ffsb,m,GLH,HE2,0.4641000
amber-ffsb,m,GLH,C,0.5973000
amber-ffsb,m,GLH,O,-0.5679000
amber-ffsb,n,GLH,N,0.0017000
amber-ffsb,n,GLH,H1,0.2391000
amber-ffsb,n,GLH,H2,0.2391000
amber-ffsb,n,GLH,H3,0.2391000
amber-ffsb,n,GLH,CA,0.0588000
amber-ffsb,n,GLH,HA,0.1202000
amber-ffsb,n,GLH,CB,0.0140645
amber-ffsb,n,GLH,HB2,0.0290384
amber-ffsb,n,GLH,HB3,0.0290384
amber-ffsb,n,GLH,CG,-0.0613480
amber-ffsb,n,GLH,HG2,0.0726115
amber-ffsb,n,GLH,HG3,0.0726115
amber-ffsb,n,GLH,CD,0.6561250
amber-ffsb,n,GLH,OE1,-0.5327457
amber-ffsb,n,GLH,OE2,-0.6146954
amber-ffsb,n,GLH,HE2,0.4641000
amber-ffsb,n,GLH,C,0.5621000
amber-ffsb,n,GLH,O,-0.5889000
amber-ffsb,c,GLH,N,-0.5192000
amber-ffsb,c,GLH,H,0.3055000
amber-ffsb,c,GLH,CA,-0.2059000
amber-ffsb,c,GLH,HA,0.1399000
amber-ffsb,c,GLH,CB,-0.0697355
amber-ffsb,c,GLH,HB2,0.0444384
amber-ffsb,c,GLH,HB3,0.0444384
amber-ffsb,c,GLH,CG,0.0297520
amber-ffsb,c,GLH,HG2,0.0493115
amber-ffsb,c,GLH,HG3,0.0493115
amber-ffsb,c,GLH,CD,0.6657250
amber-ffsb,c,GLH,OE1,-0.5358457
amber-ffsb,c,GLH,OE2,-0.6177954
amber-ffsb,c,GLH,HE2,0.4641000
amber-ffsb,c,GLH,C,0.7420000
amber-ffsb,c,GLH,O,-0.7930000
amber-ffsb,c,GLH,OXT,-0.7930000
amber-ffsb,n-,GLH,N,-0.7592000
amber-ffsb,n-,GLH,H1,0.2391000
amber-ffsb,n-,GLH,H2,0.2391000
amber-ffsb,n-,GLH,CA,0.0588000
amber-ffsb,n-,GLH,HA,0.1202000
amber-ffsb,n-,GLH,CB,0.0140645
amber-ffsb,n-,GLH,HB2,0.0290384
amber-ffsb,n-,GLH,HB3,0.0290384
amber-ffsb,n-,GLH,CG,-0.0613480
amber-ffsb,n-,GLH,HG2,0.0726115
amber-ffsb,n-,GLH,HG3,0.0726115
amber-ffsb,n-,GLH,CD,0.6561250
amber-ffsb,n-,GLH,OE1,-0.5327457
amber-ffsb,n-,GLH,OE2,-0.6146954
amber-ffsb,n-,GLH,HE2,0.4641000
amber-ffsb,n-,GLH,C,0.5621000
amber-ffsb,n-,GLH,O,-0.5889000
amber-ffsb,c+,GLH,N,-0.5192000
amber-ffsb,c+,GLH,H,0.3055000
amber-ffsb,c+,GLH,CA,-0.2059000
amber-ffsb,c+,GLH,HA,0.1399000
amber-ffsb,c+,GLH,CB,-0.0697355
amber-ffsb,c+,GLH,HB2,0.0444384
amber-ffsb,c+,GLH,HB3,0.0444384
amber-ffsb,c+,GLH,CG,0.0297520
amber-ffsb,c+,GLH,HG2,0.0493115
amber-ffsb,c+,GLH,HG3,0.0493115
amber-ffsb,c+,GLH,CD,0.6657250
amber-ffsb,c+,GLH,OE1,-0.5358457
amber-ffsb,c+,GLH,OE2,-0.6177954
amber-ffsb,c+,GLH,HE2,0.4641000
amber-ffsb,c+,GLH,C,0.7420000
amber-ffsb,c+,GLH,O,-0.5255000
amber-ffsb,c+,GLH,OXT,-0.5255000
amber-ffsb,c+,GLH,HOXT,0.4650000
amber-ffsb,m,GLY,N,-0.4157000
amber-ffsb,m,GLY,H,0.2719000
amber-ffsb,m,GLY,CA,-0.0252000
amber-ffsb,m,GLY,HA2,0.0698000
amber-ffsb,m,GLY,HA3,0.0698000
amber-ffsb,m,GLY,C,0.5973000
amber-ffsb,m,GLY,O,-0.5679000
amber-ffsb,n,GLY,N,0.2943000
amber-ffsb,n,GLY,H1,0.1642000
amber-ffsb,n,GLY,H2,0.1642000
amber-ffsb,n,GLY,H3,0.1642000
amber-ffsb,n,GLY,CA,-0.0100000
amber-ffsb,n,GLY,HA2,0.0895000
amber-ffsb,n,GLY,HA3,0.0895000
amber-ffsb,n,GLY,C,0.6163000
amber-ffsb,n,GLY,O,-0.5722000
amber-ffsb,c,GLY,N,-0.3821000
amber-ffsb,c,GLY,H,0.2681000
amber-ffsb,c,GLY,CA,-0.2493000
amber-ffsb,c,GLY,HA2,0.1056000
amber-ffsb,c,GLY,HA3,0.1056000
amber-ffsb,c,GLY,C,0.7231000
amber-ffsb,c,GLY,O,-0.7855000
amber-ffsb,c,GLY,OXT,-0.7855000
amber-ffsb,n-,GLY,N,-0.5415000
amber-ffsb,n-,GLY,H1,0.1642000
amber-ffsb,n-,GLY,H2,0.1642000
amber-ffsb,n-,GLY,CA,-0.0100000
amber-ffsb,n-,GLY,HA2,0.0895000
amber-ffsb,n-,GLY,HA3,0.0895000
amber-ffsb,n-,GLY,C,0.6163000
amber-ffsb,n-,GLY,O,-0.5722000
amber-ffsb,c+,GLY,N,-0.3821000
amber-ffsb,c+,GLY,H,0.2681000
amber-ffsb,c+,GLY,CA,-0.2493000
amber-ffsb,c+,GLY,HA2,0.1056000
amber-ffsb,c+,GLY,HA3,0.1056000
amber-ffsb,c+,GLY,C,0.7231000
amber-ffsb,c+,GLY,O,-0.5180000
amber-ffsb,c+,GLY,OXT,-0.5180000
amber-ffsb,c+,GLY,HOXT,0.4650000
amber-ffsb,m,HID,N,-0.4157000
amber-ffsb,m,HID,H,0.2719000
amber-ffsb,m,HID,CA,0.0188000
amber-ffsb,m,HID,HA,0.0881000
amber-ffsb,m,HID,CB,-0.0462000
amber-ffsb,m,HID,HB2,0.0402000
amber-ffsb,m,HID,HB3,0.0402000
amber-ffsb,m,HID,CG,-0.0266000
amber-ffsb,m,HID,ND1,-0.3811000
amber-ffsb,m,HID,HD1,0.3649000
amber-ffsb,m,HID,CD2,0.1292000
amber-ffsb,m,HID,HD2,0.1147000
amber-ffsb,m,HID,CE1,0.2057000
amber-ffsb,m,HID,HE1,0.1392000
amber-ffsb,m,HID,NE2,-0.5727000
amber-ffsb,m,HID,C,0.5973000
amber-ffsb,m,HID,O,-0.5679000
amber-ffsb,n,HID,N,0.1542000
amber-ffsb,n,HID,H1,0.1963000
amber-ffsb,n,HID,H2,0.1963000
amber-ffsb,n,HID,H3,0.1963000
amber-ffsb,n,HID,CA,0.0964000
amber-ffsb,n,HID,HA,0.0958000
amber-ffsb,n,HID,CB,0.0259000
amber-ffsb,n,HID,HB2,0.0209000
amber-ffsb,n,HID,HB3,0.0209000
amber-ffsb,n,HID,CG,-0.0399000
amber-ffsb,n,HID,ND1,-0.3819000
amber-ffsb,n,HID,HD1,0.3632000
amber-ffsb,n,HID,CD2,0.1046000
amber-ffsb,n,HID,HD2,0.1299000
amber-ffsb,n,HID,CE1,0.2127000
amber-ffsb,n,HID,HE1,0.1385000
amber-ffsb,n,HID,NE2,-0.5711000
amber-ffsb,n,HID,C,0.6123000
amber-ffsb,n,HID,O,-0.5713000
amber-ffsb,c,HID,N,-0.3821000
amber-ffsb,c,HID,H,0.2681000
amber-ffsb,c,HID,CA,-0.1739000
amber-ffsb,c,HID,HA,0.1100000
amber-ffsb,c,HID,CB,-0.1046000
amber-ffsb,c,HID,HB2,0.0565000
amber-ffsb,c,HID,HB3,0.0565000
amber-ffsb,c,HID,CG,0.0293000
amber-ffsb,c,HID,ND1,-0.3892000
amber-ffsb,c,HID,HD1,0.3755000
amber-ffsb,c,HID,CD2,0.1001000
amber-ffsb,c,HID,HD2,0.1241000
amber-ffsb,c,HID,CE1,0.1925000
amber-ffsb,c,HID,HE1,0.1418000
amber-ffsb,c,HID,NE2,-0.5629000
amber-ffsb,c,HID,C,0.7615000
amber-ffsb,c,HID,O,-0.8016000
amber-ffsb,c,HID,OXT,-0.8016000
amber-ffsb,n-,HID,N,-0.6495000
amber-ffsb,n-,HID,H1,0.1963000
amber-ffsb,n-,HID,H2,0.1963000
amber-ffsb,n-,HID,CA,0.0964000
amber-ffsb,n-,HID,HA,0.0958000
amber-ffsb,n-,HID,CB,0.0259000
amber-ffsb,n-,HID,HB2,0.0209000
amber-ffsb,n-,HID,HB3,0.0209000
amber-ffsb,n-,HID,CG,-0.0399000
amber-ffsb,n-,HID,ND1,-0.3819000
amber-ffsb,n-,HID,HD1,0.3632000
amber-ffsb,n-,HID,CD2,0.1046000
amber-ffsb,n-,HID,HD2,0.1299000
amber-ffsb,n-,HID,CE1,0.2127000
amber-ffsb,n-,HID,HE1,0.1385000
amber-ffsb,n-,HID,NE2,-0.5711000
amber-ffsb,n-,HID,C,0.6123000
amber-ffsb,n-,HID,O,-0.5713000
amber-ffsb,c+,HID,N,-0.3821000
amber-ffsb,c+,HID,H,0.2681000
amber-ffsb,c+,HID,CA,-0.1739000
amber-ffsb,c+,HID,HA,0.1100000
amber-ffsb,c+,HID,CB,-0.1046000
amber-ffsb,c+,HID,HB2,0.0565000
amber-ffsb,c+,HID,HB3,0.0565000
amber-ffsb,c+,HID,CG,0.0293000
amber-ffsb,c+,HID,ND1,-0.3892000
amber-ffsb,c+,HID,HD1,0.3755000
amber-ffsb,c+,HID,CD2,0.1001000
amber-ffsb,c+,HID,HD2,0.1241000
amber-ffsb,c+,HID,CE1,0.1925000
amber-ffsb,c+,HID,HE1,0.1418000
amber-ffsb,c+,HID,NE2,-0.5629000
amber-ffsb,c+,HID,C,0.7615000
amber-ffsb,c+,HID,O,-0.5341000
amber-ffsb,c+,HID,OXT,-0.5341000
amber-ffsb,c+,HID,HOXT,0.4650000
amber-ffsb,m,HIE,N,-0.4157000
amber-ffsb,m,HIE,H,0.2719000
amber-ffsb,m,HIE,CA,-0.0581000
amber-ffsb,m,HIE,HA,0.1360000
amber-ffsb,m,HIE,CB,-0.0074000
amber-ffsb,m,HIE,HB2,0.0367000
amber-ffsb,m,HIE,HB3,0.0367000
amber-ffsb,m,HIE,CG,0.1868000
amber-ffsb,m,HIE,ND1,-0.5432000
amber-ffsb,m,HIE,CD2,-0.2207000
amber-ffsb,m,HIE,HD2,0.1862000
amber-ffsb,m,HIE,CE1,0.1635000
amber-ffsb,m,HIE,HE1,0.1435000
amber-ffsb,m,HIE,NE2,-0.2795000
amber-ffsb,m,HIE,HE2,0.3339000
amber-ffsb,m,HIE,C,0.5973000
amber-ffsb,m,HIE,O,-0.5679000
amber-ffsb,n,HIE,N,0.1472000
amber-ffsb,n,HIE,H1,0.2016000
amber-ffsb,n,HIE,H2,0.2016000
amber-ffsb,n,HIE,H3,0.2016000
amber-ffsb,n,HIE,CA,0.0236000
amber-ffsb,n,HIE,HA,0.1380000
amber-ffsb,n,HIE,CB,0.0489000
amber-ffsb,n,HIE,HB2,0.0223000
amber-ffsb,n,HIE,HB3,0.0223000
amber-ffsb,n,HIE,CG,0.1740000
amber-ffsb,n,HIE,ND1,-0.5579000
amber-ffsb,n,HIE,CD2,-0.2349000
amber-ffsb,n,HIE,HD2,0.1963000
amber-ffsb,n,HIE,CE1,0.1804000
amber-ffsb,n,HIE,HE1,0.1397000
amber-ffsb,n,HIE,NE2,-0.2781000
amber-ffsb,n,HIE,HE2,0.3324000
amber-ffsb,n,HIE,C,0.6123000
amber-ffsb,n,HIE,O,-0.5713000
amber-ffsb,c,HIE,N,-0.3821000
amber-ffsb,c,HIE,H,0.2681000
amber-ffsb,c,HIE,CA,-0.2699000
amber-ffsb,c,HIE,HA,0.1650000
amber-ffsb,c,HIE,CB,-0.1068000
amber-ffsb,c,HIE,HB2,0.0620000
amber-ffsb,c,HIE,HB3,0.0620000
amber-ffsb,c,HIE,CG,0.2724000
amber-ffsb,c,HIE,ND1,-0.5517000
amber-ffsb,c,HIE,CD2,-0.2588000
amber-ffsb,c,HIE,HD2,0.1957000
amber-ffsb,c,HIE,CE1,0.1558000
amber-ffsb,c,HIE,HE1,0.1448000
amber-ffsb,c,HIE,NE2,-0.2670000
amber-ffsb,c,HIE,HE2,0.3319000
amber-ffsb,c,HIE,C,0.7916000
amber-ffsb,c,HIE,O,-0.8065000
amber-ffsb,c,HIE,OXT,-0.8065000
amber-ffsb,n-,HIE,N,-0.6512000
amber-ffsb,n-,HIE,H1,0.2016000
amber-ffsb,n-,HIE,H2,0.2016000
amber-ffsb,n-,HIE,CA,0.0236000
amber-ffsb,n-,HIE,HA,0.1380000
amber-ffsb,n-,HIE,CB,0.0489000
amber-ffsb,n-,HIE,HB2,0.0223000
amber-ffsb,n-,HIE,HB3,0.0223000
amber-ffsb,n-,HIE,CG,0.1740000
amber-ffsb,n-,HIE,ND1,-0.5579000
amber-ffsb,n-,HIE,CD2,-0.2349000
amber-ffsb,n-,HIE,HD2,0.1963000
amber-ffsb,n-,HIE,CE1,0.1804000
amber-ffsb,n-,HIE,HE1,0.1397000
amber-ffsb,n-,HIE,NE2,-0.2781000
amber-ffsb,n-,HIE,HE2,0.3324000
amber-ffsb,n-,HIE,C,0.6123000
amber-ffsb,n-,HIE,O,-0.5713000
amber-ffsb,c+,HIE,N,-0.3821000
amber-ffsb,c+,HIE,H,0.2681000
amber-ffsb,c+,HIE,CA,-0.2699000
amber-ffsb,c+,HIE,HA,0.1650000
amber-ffsb,c+,HIE,CB,-0.1068000
amber-ffsb,c+,HIE,HB2,0.0620000
amber-ffsb,c+,HIE,HB3,0.0620000
amber-ffsb,c+,HIE,CG,0.2724000
amber-ffsb,c+,HIE,ND1,-0.5517000
amber-ffsb,c+,HIE,CD2,-0.2588000
amber-ffsb,c+,HIE,HD2,0.1957000
amber-ffsb,c+,HIE,CE1,0.1558000
amber-ffsb,c+,HIE,HE1,0.1448000
amber-ffsb,c+,HIE,NE2,-0.2670000
amber-ffsb,c+,HIE,HE2,0.3319000
amber-ffsb,c+,HIE,C,0.7916000
amber-ffsb,c+,HIE,O,-0.5390000
amber-ffsb,c+,HIE,OXT,-0.5390000
amber-ffsb,c+,HIE,HOXT,0.4650000
amber-ffsb,m,HIP,N,-0.3479000
amber-ffsb,m,HIP,H,0.2747000
amber-ffsb,m,HIP,CA,-0.1354000
amber-ffsb,m,HIP,HA,0.1212000
amber-ffsb,m,HIP,CB,-0.0414000
amber-ffsb,m,HIP,HB2,0.0810000
amber-ffsb,m,HIP,HB3,0.0810000
amber-ffsb,m,HIP,CG,-0.0012000
amber-ffsb,m,HIP,ND1,-0.1513000
amber-ffsb,m,HIP,HD1,0.3866000
amber-ffsb,m,HIP,CD2,-0.1141000
amber-ffsb,m,HIP,HD2,0.2317000
amber-ffsb,m,HIP,CE1,-0.0170000
amber-ffsb,m,HIP,HE1,0.2681000
amber-ffsb,m,HIP,NE2,-0.1718000
amber-ffsb,m,HIP,HE2,0.3911000
amber-ffsb,m,HIP,C,0.7341000
amber-ffsb,m,HIP,O,-0.5894000
amber-ffsb,n,HIP,N,0.2560000
amber-ffsb,n,HIP,H1,0.1704000
amber-ffsb,n,HIP,H2,0.1704000
amber-ffsb,n,HIP,H3,0.1704000
amber-ffsb,n,HIP,CA,0.0581000
amber-ffsb,n,HIP,HA,0.1047000
amber-ffsb,n,HIP,CB,0.0484000
amber-ffsb,n,HIP,HB2,0.0531000
amber-ffsb,n,HIP,HB3,0.0531000
amber-ffsb,n,HIP,CG,-0.0236000
amber-ffsb,n,HIP,ND1,-0.1510000
amber-ffsb,n,HIP,HD1,0.3821000
amber-ffsb,n,HIP,CD2,-0.1433000
amber-ffsb,n,HIP,HD2,0.2495000
amber-ffsb,n,HIP,CE1,-0.0011000
amber-ffsb,n,HIP,HE1,0.2645000
amber-ffsb,n,HIP,NE2,-0.1739000
amber-ffsb,n,HIP,HE2,0.3921000
amber-ffsb,n,HIP,C,0.7214000
amber-ffsb,n,HIP,O,-0.6013000
amber-ffsb,c,HIP,N,-0.3481000
amber-ffsb,c,HIP,H,0.2764000
amber-ffsb,c,HIP,CA,-0.1445000
amber-ffsb,c,HIP,HA,0.1115000
amber-ffsb,c,HIP,CB,-0.0800000
amber-ffsb,c,HIP,HB2,0.0868000
amber-ffsb,c,HIP,HB3,0.0868000
amber-ffsb,c,HIP,CG,0.0298000
amber-ffsb,c,HIP,ND1,-0.1501000
amber-ffsb,c,HIP,HD1,0.3883000
amber-ffsb,c,HIP,CD2,-0.1256000
amber-ffsb,c,HIP,HD2,0.2336000
amber-ffsb,c,HIP,CE1,-0.0251000
amber-ffsb,c,HIP,HE1,0.2694000
amber-ffsb,c,HIP,NE2,-0.1683000
amber-ffsb,c,HIP,HE2,0.3913000
amber-ffsb,c,HIP,C,0.8032000
amber-ffsb,c,HIP,O,-0.8177000
amber-ffsb,c,HIP,OXT,-0.8177000
amber-ffsb,n-,HIP,N,-0.5736000
amber-ffsb,n-,HIP,H1,0.1704000
amber-ffsb,n-,HIP,H2,0.1704000
amber-ffsb,n-,HIP,CA,0.0581000
amber-ffsb,n-,HIP,HA,0.1047000
amber-ffsb,n-,HIP,CB,0.0484000
amber-ffsb,n-,HIP,HB2,0.0531000
amber-ffsb,n-,HIP,HB3,0.0531000
amber-ffsb,n-,HIP,CG,-0.0236000
amber-ffsb,n-,HIP,ND1,-0.1510000
amber-ffsb,n-,HIP,HD1,0.3821000
amber-ffsb,n-,HIP,CD2,-0.1433000
amber-ffsb,n-,HIP,HD2,0.2495000
amber-ffsb,n-,HIP,CE1,-0.0011000
amber-ffsb,n-,HIP,HE1,0.2645000
amber-ffsb,n-,HIP,NE2,-0.1739000
amber-ffsb,n-,HIP,HE2,0.3921000
amber-ffsb,n-,HIP,C,0.7214000
amber-ffsb,n-,HIP,O,-0.6013000
amber-ffsb,c+,HIP,N,-0.3481000
amber-ffsb,c+,HIP,H,0.2764000
amber-ffsb,c+,HIP,CA,-0.1445000
amber-ffsb,c+,HIP,HA,0.1115000
amber-ffsb,c+,HIP,CB,-0.0800000
amber-ffsb,c+,HIP,HB2,0.0868000
amber-ffsb,c+,HIP,HB3,0.0868000
amber-ffsb,c+,HIP,CG,0.0298000
amber-ffsb,c+,HIP,ND1,-0.1501000
amber-ffsb,c+,HIP,HD1,0.3883000
amber-ffsb,c+,HIP,CD2,-0.1256000
amber-ffsb,c+,HIP,HD2,0.2336000
amber-ffsb,c+,HIP,CE1,-0.0251000
amber-ffsb,c+,HIP,HE1,0.2694000
amber-ffsb,c+,HIP,NE2,-0.1683000
amber-ffsb,c+,HIP,HE2,0.3913000
amber-ffsb,c+,HIP,C,0.8032000
amber-ffsb,c+,HIP,O,-0.5502000
amber-ffsb,c+,HIP,OXT,-0.5502000
amber-ffsb,c+,HIP,HOXT,0.4650000
amber-ffsb,m,ILE,N,-0.4157000
amber-ffsb,m,ILE,H,0.2719000
amber-ffsb,m,ILE,CA,-0.0597000
amber-ffsb,m,ILE,HA,0.0869000
amber-ffsb,m,ILE,CB,0.1303000
amber-ffsb,m,ILE,HB,0.0187000
amber-ffsb,m,ILE,CG2,-0.3204000
amber-ffsb,m,ILE,HG21,0.0882000
amber-ffsb,m,ILE,HG22,0.0882000
amber-ffsb,m,ILE,HG23,0.0882000
amber-ffsb,m,ILE,CG1,-0.0430000
amber-ffsb,m,ILE,HG12,0.0236000
amber-ffsb,m,ILE,HG13,0.0236000
amber-ffsb,m,ILE,CD1,-0.0660000
amber-ffsb,m,ILE,HD11,0.0186000
amber-ffsb,m,ILE,HD12,0.0186000
amber-ffsb,m,ILE,HD13,0.0186000
amber-ffsb,m,ILE,C,0.5973000
amber-ffsb,m,ILE,O,-0.5679000
amber-ffsb,n,ILE,N,0.0311000
amber-ffsb,n,ILE,H1,0.2329000
amber-ffsb,n,ILE,H2,0.2329000
amber-ffsb,n,ILE,H3,0.2329000
amber-ffsb,n,ILE,CA,0.0257000
amber-ffsb,n,ILE,HA,0.1031000
amber-ffsb,n,ILE,CB,0.1885000
amber-ffsb,n,ILE,HB,0.0213000
amber-ffsb,n,ILE,CG2,-0.3720000
amber-ffsb,n,ILE,HG21,0.0947000
amber-ffsb,n,ILE,HG22,0.0947000
amber-ffsb,n,ILE,HG23,0.0947000
amber-ffsb,n,ILE,CG1,-0.0387000
amber-ffsb,n,ILE,HG12,0.0201000
amber-ffsb,n,ILE,HG13,0.0201000
amber-ffsb,n,ILE,CD1,-0.0908000
amber-ffsb,n,ILE,HD11,0.0226000
amber-ffsb,n,ILE,HD12,0.0226000
amber-ffsb,n,ILE,HD13,0.0226000
amber-ffsb,n,ILE,C,0.6123000
amber-ffsb,n,ILE,O,-0.5713000
amber-ffsb,c,ILE,N,-0.3821000
amber-ffsb,c,ILE,H,0.2681000
amber-ffsb,c,ILE,CA,-0.3100000
amber-ffsb,c,ILE,HA,0.1375000
amber-ffsb,c,ILE,CB,0.0363000
amber-ffsb,c,ILE,HB,0.0766000
amber-ffsb,c,ILE,CG2,-0.3498000
amber-ffsb,c,ILE,HG21,0.1021000
amber-ffsb,c,ILE,HG22,0.1021000
amber-ffsb,c,ILE,HG23,0.1021000
amber-ffsb,c,ILE,CG1,-0.0323000
amber-ffsb,c,ILE,HG12,0.0321000
amber-ffsb,c,ILE,HG13,0.0321000
amber-ffsb,c,ILE,CD1,-0.0699000
amber-ffsb,c,ILE,HD11,0.0196000
amber-ffsb,c,ILE,HD12,0.0196000
amber-ffsb,c,ILE,HD13,0.0196000
amber-ffsb,c,ILE,C,0.8343000
amber-ffsb,c,ILE,O,-0.8190000
amber-ffsb,c,ILE,OXT,-0.8190000
amber-ffsb,n-,ILE,N,-0.7360000
amber-ffsb,n-,ILE,H1,0.2329000
amber-ffsb,n-,ILE,H2,0.2329000
amber-ffsb,n-,ILE,CA,0.0257000
amber-ffsb,n-,ILE,HA,0.1031000
amber-ffsb,n-,ILE,CB,0.1885000
amber-ffsb,n-,ILE,HB,0.0213000
amber-ffsb,n-,ILE,CG2,-0.3720000
amber-ffsb,n-,ILE,HG21,0.0947000
amber-ffsb,n-,ILE,HG22,0.0947000
amber-ffsb,n-,ILE,HG23,0.0947000
amber-ffsb,n-,ILE,CG1,-0.0387000
amber-ffsb,n-,ILE,HG12,0.0201000
amber-ffsb,n-,ILE,HG13,0.0201000
amber-ffsb,n-,ILE,CD1,-0.0908000
amber-ffsb,n-,ILE,HD11,0.0226000
amber-ffsb,n-,ILE,HD12,0.0226000
amber-ffsb,n-,ILE,HD13,0.0226000
amber-ffsb,n-,ILE,C,0.6123000
amber-ffsb,n-,ILE,O,-0.5713000
amber-ffsb,c+,ILE,N,-0.3821000
amber-ffsb,c+,ILE,H,0.2681000
amber-ffsb,c+,ILE,CA,-0.3100000
amber-ffsb,c+,ILE,HA,0.1375000
amber-ffsb,c+,ILE,CB,0.0363000
amber-ffsb,c+,ILE,HB,0.0766000
amber-ffsb,c+,ILE,CG2,-0.3498000
amber-ffsb,c+,ILE,HG21,0.1021000
amber-ffsb,c+,ILE,HG22,0.1021000
amber-ffsb,c+,ILE,HG23,0.1021000
amber-ffsb,c+,ILE,CG1,-0.0323000
amber-ffsb,c+,ILE,HG12,0.0321000
amber-ffsb,c+,ILE,HG13,0.0321000
amber-ffsb,c+,ILE,CD1,-0.0699000
amber-ffsb,c+,ILE,HD11,0.0196000
amber-ffsb,c+,ILE,HD12,0.0196000
amber-ffsb,c+,ILE,HD13,0.0196000
amber-ffsb,c+,ILE,C,0.8343000
amber-ffsb,c+,ILE,O,-0.5515000
amber-ffsb,c+,ILE,OXT,-0.5515000
amber-ffsb,c+,ILE,HOXT,0.4650000
amber-ffsb,m,LEU,N,-0.4157000
amber-ffsb,m,LEU,H,0.2719000
amber-ffsb,m,LEU,CA,-0.0518000
amber-ffsb,m,LEU,HA,0.0922000
amber-ffsb,m,LEU,CB,-0.1102000
amber-ffsb,m,LEU,HB2,0.0457000
amber-ffsb,m,LEU,HB3,0.0457000
amber-ffsb,m,LEU,CG,0.3531000
amber-ffsb,m,LEU,HG,-0.0361000
amber-ffsb,m,LEU,CD1,-0.4121000
amber-ffsb,m,LEU,HD11,0.1000000
amber-ffsb,m,LEU,HD12,0.1000000
amber-ffsb,m,LEU,HD13,0.1000000
amber-ffsb,m,LEU,CD2,-0.4121000
amber-ffsb,m,LEU,HD21,0.1000000
amber-ffsb,m,LEU,HD22,0.1000000
amber-ffsb,m,LEU,HD23,0.1000000
amber-ffsb,m,LEU,C,0.5973000
amber-ffsb,m,LEU,O,-0.5679000
amber-ffsb,n,LEU,N,0.1010000
amber-ffsb,n,LEU,H1,0.2148000
amber-ffsb,n,LEU,H2,0.2148000
amber-ffsb,n,LEU,H3,0.2148000
amber-ffsb,n,LEU,CA,0.0104000
amber-ffsb,n,LEU,HA,0.1053000
amber-ffsb,n,LEU,CB,-0.0244000
amber-ffsb,n,LEU,HB2,0.0256000
amber-ffsb,n,LEU,HB3,0.0256000
amber-ffsb,n,LEU,CG,0.3421000
amber-ffsb,n,LEU,HG,-0.0380000
amber-ffsb,n,LEU,CD1,-0.4106000
amber-ffsb,n,LEU,HD11,0.0980000
amber-ffsb,n,LEU,HD12,0.0980000
amber-ffsb,n,LEU,HD13,0.0980000
amber-ffsb,n,LEU,CD2,-0.4104000
amber-ffsb,n,LEU,HD21,0.0980000
amber-ffsb,n,LEU,HD22,0.0980000
amber-ffsb,n,LEU,HD23,0.0980000
amber-ffsb,n,LEU,C,0.6123000
amber-ffsb,n,LEU,O,-0.5713000
amber-ffsb,c,LEU,N,-0.3821000
amber-ffsb,c,LEU,H,0.2681000
amber-ffsb,c,LEU,CA,-0.2847000
amber-ffsb,c,LEU,HA,0.1346000
amber-ffsb,c,LEU,CB,-0.2469000
amber-ffsb,c,LEU,HB2,0.0974000
amber-ffsb,c,LEU,HB3,0.0974000
amber-ffsb,c,LEU,CG,0.3706000
amber-ffsb,c,LEU,HG,-0.0374000
amber-ffsb,c,LEU,CD1,-0.4163000
amber-ffsb,c,LEU,HD11,0.1038000
amber-ffsb,c,LEU,HD12,0.1038000
amber-ffsb,c,LEU,HD13,0.1038000
amber-ffsb,c,LEU,CD2,-0.4163000
amber-ffsb,c,LEU,HD21,0.1038000
amber-ffsb,c,LEU,HD22,0.1038000
amber-ffsb,c,LEU,HD23,0.1038000
amber-ffsb,c,LEU,C,0.8326000
amber-ffsb,c,LEU,O,-0.8199000
amber-ffsb,c,LEU,OXT,-0.8199000
amber-ffsb,n-,LEU,N,-0.6842000
amber-ffsb,n-,LEU,H1,0.2148000
amber-ffsb,n-,LEU,H2,0.2148000
amber-ffsb,n-,LEU,CA,0.0104000
amber-ffsb,n-,LEU,HA,0.1053000
amber-ffsb,n-,LEU,CB,-0.0244000
amber-ffsb,n-,LEU,HB2,0.0256000
amber-ffsb,n-,LEU,HB3,0.0256000
amber-ffsb,n-,LEU,CG,0.3421000
amber-ffsb,n-,LEU,HG,-0.0380000
amber-ffsb,n-,LEU,CD1,-0.4106000
amber-ffsb,n-,LEU,HD11,0.0980000
amber-ffsb,n-,LEU,HD12,0.0980000
amber-ffsb,n-,LEU,HD13,0.0980000
amber-ffsb,n-,LEU,CD2,-0.4104000
amber-ffsb,n-,LEU,HD21,0.0980000
amber-ffsb,n-,LEU,HD22,0.0980000
amber-ffsb,n-,LEU,HD23,0.0980000
amber-ffsb,n-,LEU,C,0.6123000
amber-ffsb,n-,LEU,O,-0.5713000
amber-ffsb,c+,LEU,N,-0.3821000
amber-ffsb,c+,LEU,H,0.2681000
amber-ffsb,c+,LEU,CA,-0.2847000
amber-ffsb,c+,LEU,HA,0.1346000
amber-ffsb,c+,LEU,CB,-0.2469000
amber-ffsb,c+,LEU,HB2,0.0974000
amber-ffsb,c+,LEU,HB3,0.0974000
amber-ffsb,c+,LEU,CG,0.3706000
amber-ffsb,c+,LEU,HG,-0.0374000
amber-ffsb,c+,LEU,CD1,-0.4163000
amber-ffsb,c+,LEU,HD11,0.1038000
amber-ffsb,c+,LEU,HD12,0.1038000
amber-ffsb,c+,LEU,HD13,0.1038000
amber-ffsb,c+,LEU,CD2,-0.4163000
amber-ffsb,c+,LEU,HD21,0.1038000
amber-ffsb,c+,LEU,HD22,0.1038000
amber-ffsb,c+,LEU,HD23,0.1038000
amber-ffsb,c+,LEU,C,0.8326000
amber-ffsb,c+,LEU,O,-0.5524000
amber-ffsb,c+,LEU,OXT,-0.5524000
amber-ffsb,c+,LEU,HOXT,0.4650000
amber-ffsb,m,LYS,N,-0.3479000
amber-ffsb,m,LYS,H,0.2747000
amber-ffsb,m,LYS,CA,-0.2400000
amber-ffsb,m,LYS,HA,0.1426000
amber-ffsb,m,LYS,CB,-0.0094000
amber-ffsb,m,LYS,HB2,0.0362000
amber-ffsb,m,LYS,HB3,0.0362000
amber-ffsb,m,LYS,CG,0.0187000
amber-ffsb,m,LYS,HG2,0.0103000
amber-ffsb,m,LYS,HG3,0.0103000
amber-ffsb,m,LYS,CD,-0.0479000
amber-ffsb,m,LYS,HD2,0.0621000
amber-ffsb,m,LYS,HD3,0.0621000
amber-ffsb,m,LYS,CE,-0.0143000
amber-ffsb,m,LYS,HE2,0.1135000
amber-ffsb,m,LYS,HE3,0.1135000
amber-ffsb,m,LYS,NZ,-0.3854000
amber-ffsb,m,LYS,HZ1,0.3400000
amber-ffsb,m,LYS,HZ2,0.3400000
amber-ffsb,m,LYS,HZ3,0.3400000
amber-ffsb,m,LYS,C,0.7341000
amber-ffsb,m,LYS,O,-0.5894000
amber-ffsb,n,LYS,N,0.0966000
amber-ffsb,n,LYS,H1,0.2165000
amber-ffsb,n,LYS,H2,0.2165000
amber-ffsb,n,LYS,H3,0.2165000
amber-ffsb,n,LYS,CA,-0.0015000
amber-ffsb,n,LYS,HA,0.1180000
amber-ffsb,n,LYS,CB,0.0212000
amber-ffsb,n,LYS,HB2,0.0283000
amber-ffsb,n,LYS,HB3,0.0283000
amber-ffsb,n,LYS,CG,-0.0048000
amber-ffsb,n,LYS,HG2,0.0121000
amber-ffsb,n,LYS,HG3,0.0121000
amber-ffsb,n,LYS,CD,-0.0608000
amber-ffsb,n,LYS,HD2,0.0633000
amber-ffsb,n,LYS,HD3,0.0633000
amber-ffsb,n,LYS,CE,-0.0181000
amber-ffsb,n,LYS,HE2,0.1171000
amber-ffsb,n,LYS,HE3,0.1171000
amber-ffsb,n,LYS,NZ,-0.3764000
amber-ffsb,n,LYS,HZ1,0.3382000
amber-ffsb,n,LYS,HZ2,0.3382000
amber-ffsb,n,LYS,HZ3,0.3382000
amber-ffsb,n,LYS,C,0.7214000
amber-ffsb,n,LYS,O,-0.6013000
amber-ffsb,c,LYS,N,-0.3481000
amber-ffsb,c,LYS,H,0.2764000
amber-ffsb,c,LYS,CA,-0.2903000
amber-ffsb,c,LYS,HA,0.1438000
amber-ffsb,c,LYS,CB,-0.0538000
amber-ffsb,c,LYS,HB2,0.0482000
amber-ffsb,c,LYS,HB3,0.0482000
amber-ffsb,c,LYS,CG,0.0227000
amber-ffsb,c,LYS,HG2,0.0134000
amber-ffsb,c,LYS,HG3,0.0134000
amber-ffsb,c,LYS,CD,-0.0392000
amber-ffsb,c,LYS,HD2,0.0611000
amber-ffsb,c,LYS,HD3,0.0611000
amber-ffsb,c,LYS,CE,-0.0176000
amber-ffsb,c,LYS,HE2,0.1121000
amber-ffsb,c,LYS,HE3,0.1121000
amber-ffsb,c,LYS,NZ,-0.3741000
amber-ffsb,c,LYS,HZ1,0.3374000
amber-ffsb,c,LYS,HZ2,0.3374000
amber-ffsb,c,LYS,HZ3,0.3374000
amber-ffsb,c,LYS,C,0.8488000
amber-ffsb,c,LYS,O,-0.8252000
amber-ffsb,c,LYS,OXT,-0.8252000
amber-ffsb,n-,LYS,N,-0.6869000
amber-ffsb,n-,LYS,H1,0.2165000
amber-ffsb,n-,LYS,H2,0.2165000
amber-ffsb,n-,LYS,CA,-0.0015000
amber-ffsb,n-,LYS,HA,0.1180000
amber-ffsb,n-,LYS,CB,0.0212000
amber-ffsb,n-,LYS,HB2,0.0283000
amber-ffsb,n-,LYS,HB3,0.0283000
amber-ffsb,n-,LYS,CG,-0.0048000
amber-ffsb,n-,LYS,HG2,0.0121000
amber-ffsb,n-,LYS,HG3,0.0121000
amber-ffsb,n-,LYS,CD,-0.0608000
amber-ffsb,n-,LYS,HD2,0.0633000
amber-ffsb,n-,LYS,HD3,0.0633000
amber-ffsb,n-,LYS,CE,-0.0181000
amber-ffsb,n-,LYS,HE2,0.1171000
amber-ffsb,n-,LYS,HE3,0.1171000
amber-ffsb,n-,LYS,NZ,-0.3764000
amber-ffsb,n-,LYS,HZ1,0.3382000
amber-ffsb,n-,LYS,HZ2,0.3382000
amber-ffsb,n-,LYS,HZ3,0.3382000
amber-ffsb,n-,LYS,C,0.7214000
amber-ffsb,n-,LYS,O,-0.6013000
amber-ffsb,c+,LYS,N,-0.3481000
amber-ffsb,c+,LYS,H,0.2764000
amber-ffsb,c+,LYS,CA,-0.2903000
amber-ffsb,c+,LYS,HA,0.1438000
amber-ffsb,c+,LYS,CB,-0.0538000
amber-ffsb,c+,LYS,HB2,0.0482000
amber-ffsb,c+,LYS,HB3,0.0482000
amber-ffsb,c+,LYS,CG,0.0227000
amber-ffsb,c+,LYS,HG2,0.0134000
amber-ffsb,c+,LYS,HG3,0.0134000
amber-ffsb,c+,LYS,CD,-0.0392000
amber-ffsb,c+,LYS,HD2,0.0611000
amber-ffsb,c+,LYS,HD3,0.0611000
amber-ffsb,c+,LYS,CE,-0.0176000
amber-ffsb,c+,LYS,HE2,0.1121000
amber-ffsb,c+,LYS,HE3,0.1121000
amber-ffsb,c+,LYS,NZ,-0.3741000
amber-ffsb,c+,LYS,HZ1,0.3374000
amber-ffsb,c+,LYS,HZ2,0.3374000
amber-ffsb,c+,LYS,HZ3,0.3374000
amber-ffsb,c+,LYS,C,0.8488000
amber-ffsb,c+,LYS,O,-0.5577000
amber-ffsb,c+,LYS,OXT,-0.5577000
amber-ffsb,c+,LYS,HOXT,0.4650000
amber-ffsb,m,LYN,N,-0.4157000
amber-ffsb,m,LYN,H,0.2719000
amber-ffsb,m,LYN,CA,-0.0720600
amber-ffsb,m,LYN,HA,0.0994000
amber-ffsb,m,LYN,CB,-0.0484500
amber-ffsb,m,LYN,HB2,0.0340000
amber-ffsb,m,LYN,HB3,0.0340000
amber-ffsb,m,LYN,CG,0.0661200
amber-ffsb,m,LYN,HG2,0.0104100
amber-ffsb,m,LYN,HG3,0.0104100
amber-ffsb,m,LYN,CD,-0.0376800
amber-ffsb,m,LYN,HD2,0.0115500
amber-ffsb,m,LYN,HD3,0.0115500
amber-ffsb,m,LYN,CE,0.3260400
amber-ffsb,m,LYN,HE2,-0.0335800
amber-ffsb,m,LYN,HE3,-0.0335800
amber-ffsb,m,LYN,NZ,-1.0358100
amber-ffsb,m,LYN,HZ1,0.3860400
amber-ffsb,m,LYN,HZ2,0.3860400
amber-ffsb,m,LYN,C,0.5973000
amber-ffsb,m,LYN,O,-0.5679000
amber-ffsb,n,LYN,N,0.0966000
amber-ffsb,n,LYN,H1,0.2165000
amber-ffsb,n,LYN,H2,0.2165000
amber-ffsb,n,LYN,H3,0.2165000
amber-ffsb,n,LYN,CA,-0.0015000
amber-ffsb,n,LYN,HA,0.1180000
amber-ffsb,n,LYN,CB,-0.0484500
amber-ffsb,n,LYN,HB2,0.0340000
amber-ffsb,n,LYN,HB3,0.0340000
amber-ffsb,n,LYN,CG,0.0661200
amber-ffsb,n,LYN,HG2,0.0104100
amber-ffsb,n,LYN,HG3,0.0104100
amber-ffsb,n,LYN,CD,-0.0376800
amber-ffsb,n,LYN,HD2,0.0115500
amber-ffsb,n,LYN,HD3,0.0115500
amber-ffsb,n,LYN,CE,0.3260400
amber-ffsb,n,LYN,HE2,-0.0335800
amber-ffsb,n,LYN,HE3,-0.0335800
amber-ffsb,n,LYN,NZ,-1.1055700
amber-ffsb,n,LYN,HZ1,0.3860400
amber-ffsb,n,LYN,HZ2,0.3860400
amber-ffsb,n,LYN,C,0.7214000
amber-ffsb,n,LYN,O,-0.6013000
amber-ffsb,c,LYN,N,-0.3481000
amber-ffsb,c,LYN,H,0.2764000
amber-ffsb,c,LYN,CA,-0.2903000
amber-ffsb,c,LYN,HA,0.1438000
amber-ffsb,c,LYN,CB,-0.0484500
amber-ffsb,c,LYN,HB2,0.0340000
amber-ffsb,c,LYN,HB3,0.0340000
amber-ffsb,c,LYN,CG,0.0661200
amber-ffsb,c,LYN,HG2,0.0104100
amber-ffsb,c,LYN,HG3,0.0104100
amber-ffsb,c,LYN,CD,-0.0376800
amber-ffsb,c,LYN,HD2,0.0115500
amber-ffsb,c,LYN,HD3,0.0115500
amber-ffsb,c,LYN,CE,0.3260400
amber-ffsb,c,LYN,HE2,-0.0335800
amber-ffsb,c,LYN,HE3,-0.0335800
amber-ffsb,c,LYN,NZ,-1.1030700
amber-ffsb,c,LYN,HZ1,0.3860400
amber-ffsb,c,LYN,HZ2,0.3860400
amber-ffsb,c,LYN,C,0.8488000
amber-ffsb,c,LYN,O,-0.8252000
amber-ffsb,c,LYN,OXT,-0.8252000
amber-ffsb,n-,LYN,N,-0.6869000
amber-ffsb,n-,LYN,H1,0.2165000
amber-ffsb,n-,LYN,H2,0.2165000
amber-ffsb,n-,LYN,CA,-0.0015000
amber-ffsb,n-,LYN,HA,0.1180000
amber-ffsb,n-,LYN,CB,-0.0484500
amber-ffsb,n-,LYN,HB2,0.0340000
amber-ffsb,n-,LYN,HB3,0.0340000
amber-ffsb,n-,LYN,CG,0.0661200
amber-ffsb,n-,LYN,HG2,0.0104100
amber-ffsb,n-,LYN,HG3,0.0104100
amber-ffsb,n-,LYN,CD,-0.0376800
amber-ffsb,n-,LYN,HD2,0.0115500
amber-ffsb,n-,LYN,HD3,0.0115500
amber-ffsb,n-,LYN,CE,0.3260400
amber-ffsb,n-,LYN,HE2,-0.0335800
amber-ffsb,n-,LYN,HE3,-0.0335800
amber-ffsb,n-,LYN,NZ,-1.1055700
amber-ffsb,n-,LYN,HZ1,0.3860400
amber-ffsb,n-,LYN,HZ2,0.3860400
amber-ffsb,n-,LYN,C,0.7214000
amber-ffsb,n-,LYN,O,-0.6013000
amber-ffsb,c+,LYN,N,-0.3481000
amber-ffsb,c+,LYN,H,0.2764000
amber-ffsb,c+,LYN,CA,-0.2903000
amber-ffsb,c+,LYN,HA,0.1438000
amber-ffsb,c+,LYN,CB,-0.0484500
amber-ffsb,c+,LYN,HB2,0.0340000
amber-ffsb,c+,LYN,HB3,0.0340000
amber-ffsb,c+,LYN,CG,0.0661200
amber-ffsb,c+,LYN,HG2,0.0104100
amber-ffsb,c+,LYN,HG3,0.0104100
amber-ffsb,c+,LYN,CD,-0.0376800
amber-ffsb,c+,LYN,HD2,0.0115500
amber-ffsb,c+,LYN,HD3,0.0115500
amber-ffsb,c+,LYN,CE,0.3260400
amber-ffsb,c+,LYN,HE2,-0.0335800
amber-ffsb,c+,LYN,HE3,-0.0335800
amber-ffsb,c+,LYN,NZ,-1.1030700
amber-ffsb,c+,LYN,HZ1,0.3860400
amber-ffsb,c+,LYN,HZ2,0.3860400
amber-ffsb,c+,LYN,C,0.8488000
amber-ffsb,c+,LYN,O,-0.5577000
amber-ffsb,c+,LYN,OXT,-0.5577000
amber-ffsb,c+,LYN,HOXT,0.4650000
amber-ffsb,m,MET,N,-0.4157000
amber-ffsb,m,MET,H,0.2719000
amber-ffsb,m,MET,CA,-0.0237000
amber-ffsb,m,MET,HA,0.0880000
amber-ffsb,m,MET,CB,0.0342000
amber-ffsb,m,MET,HB2,0.0241000
amber-ffsb,m,MET,HB3,0.0241000
amber-ffsb,m,MET,CG,0.0018000
amber-ffsb,m,MET,HG2,0.0440000
amber-ffsb,m,MET,HG3,0.0440000
amber-ffsb,m,MET,SD,-0.2737000
amber-ffsb,m,MET,CE,-0.0536000
amber-ffsb,m,MET,HE1,0.0684000
amber-ffsb,m,MET,HE2,0.0684000
amber-ffsb,m,MET,HE3,0.0684000
amber-ffsb,m,MET,C,0.5973000
amber-ffsb,m,MET,O,-0.5679000
amber-ffsb,n,MET,N,0.1592000
amber-ffsb,n,MET,H1,0.1984000
amber-ffsb,n,MET,H2,0.1984000
amber-ffsb,n,MET,H3,0.1984000
amber-ffsb,n,MET,CA,0.0221000
amber-ffsb,n,MET,HA,0.1116000
amber-ffsb,n,MET,CB,0.0865000
amber-ffsb,n,MET,HB2,0.0125000
amber-ffsb,n,MET,HB3,0.0125000
amber-ffsb,n,MET,CG,0.0334000
amber-ffsb,n,MET,HG2,0.0292000
amber-ffsb,n,MET,HG3,0.0292000
amber-ffsb,n,MET,SD,-0.2774000
amber-ffsb,n,MET,CE,-0.0341000
amber-ffsb,n,MET,HE1,0.0597000
amber-ffsb,n,MET,HE2,0.0597000
amber-ffsb,n,MET,HE3,0.0597000
amber-ffsb,n,MET,C,0.6123000
amber-ffsb,n,MET,O,-0.5713000
amber-ffsb,c,MET,N,-0.3821000
amber-ffsb,c,MET,H,0.2681000
amber-ffsb,c,MET,CA,-0.2597000
amber-ffsb,c,MET,HA,0.1277000
amber-ffsb,c,MET,CB,-0.0236000
amber-ffsb,c,MET,HB2,0.0480000
amber-ffsb,c,MET,HB3,0.0480000
amber-ffsb,c,MET,CG,0.0492000
amber-ffsb,c,MET,HG2,0.0317000
amber-ffsb,c,MET,HG3,0.0317000
amber-ffsb,c,MET,SD,-0.2692000
amber-ffsb,c,MET,CE,-0.0376000
amber-ffsb,c,MET,HE1,0.0625000
amber-ffsb,c,MET,HE2,0.0625000
amber-ffsb,c,MET,HE3,0.0625000
amber-ffsb,c,MET,C,0.8013000
amber-ffsb,c,MET,O,-0.8105000
amber-ffsb,c,MET,OXT,-0.8105000
amber-ffsb,n-,MET,N,-0.6424000
amber-ffsb,n-,MET,H1,0.1984000
amber-ffsb,n-,MET,H2,0.1984000
amber-ffsb,n-,MET,CA,0.0221000
amber-ffsb,n-,MET,HA,0.1116000
amber-ffsb,n-,MET,CB,0.0865000
amber-ffsb,n-,MET,HB2,0.0125000
amber-ffsb,n-,MET,HB3,0.0125000
amber-ffsb,n-,MET,CG,0.0334000
amber-ffsb,n-,MET,HG2,0.0292000
amber-ffsb,n-,MET,HG3,0.0292000
amber-ffsb,n-,MET,SD,-0.2774000
amber-ffsb,n-,MET,CE,-0.0341000
amber-ffsb,n-,MET,HE1,0.0597000
amber-ffsb,n-,MET,HE2,0.0597000
amber-ffsb,n-,MET,HE3,0.0597000
amber-ffsb,n-,MET,C,0.6123000
amber-ffsb,n-,MET,O,-0.5713000
amber-ffsb,c+,MET,N,-0.3821000
amber-ffsb,c+,MET,H,0.2681000
amber-ffsb,c+,MET,CA,-0.2597000
amber-ffsb,c+,MET,HA,0.1277000
amber-ffsb,c+,MET,CB,-0.0236000
amber-ffsb,c+,MET,HB2,0.0480000
amber-ffsb,c+,MET,HB3,0.0480000
amber-ffsb,c+,MET,CG,0.0492000
amber-ffsb,c+,MET,HG2,0.0317000
amber-ffsb,c+,MET,HG3,0.0317000
amber-ffsb,c+,MET,SD,-0.2692000
amber-ffsb,c+,MET,CE,-0.0376000
amber-ffsb,c+,MET,HE1,0.0625000
amber-ffsb,c+,MET,HE2,0.0625000
amber-ffsb,c+,MET,HE3,0.0625000
amber-ffsb,c+,MET,C,0.8013000
amber-ffsb,c+,MET,O,-0.5430000
amber-ffsb,c+,MET,OXT,-0.5430000
amber-ffsb,c+,MET,HOXT,0.4650000
amber-ffsb,m,PHE,N,-0.4157000
amber-ffsb,m,PHE,H,0.2719000
amber-ffsb,m,PHE,CA,-0.0024000
amber-ffsb,m,PHE,HA,0.0978000
amber-ffsb,m,PHE,CB,-0.0343000
amber-ffsb,m,PHE,HB2,0.0295000
amber-ffsb,m,PHE,HB3,0.0295000
amber-ffsb,m,PHE,CG,0.0118000
amber-ffsb,m,PHE,CD1,-0.1256000
amber-ffsb,m,PHE,HD1,0.1330000
amber-ffsb,m,PHE,CD2,-0.1256000
amber-ffsb,m,PHE,HD2,0.1330000
amber-ffsb,m,PHE,CE1,-0.1704000
amber-ffsb,m,PHE,HE1,0.1430000
amber-ffsb,m,PHE,CE2,-0.1704000
amber-ffsb,m,PHE,HE2,0.1430000
amber-ffsb,m,PHE,CZ,-0.1072000
amber-ffsb,m,PHE,HZ,0.1297000
amber-ffsb,m,PHE,C,0.5973000
amber-ffsb,m,PHE,O,-0.5679000
amber-ffsb,n,PHE,N,0.1737000
amber-ffsb,n,PHE,H1,0.1921000
amber-ffsb,n,PHE,H2,0.1921000
amber-ffsb,n,PHE,H3,0.1921000
amber-ffsb,n,PHE,CA,0.0733000
amber-ffsb,n,PHE,HA,0.1041000
amber-ffsb,n,PHE,CB,0.0330000
amber-ffsb,n,PHE,HB2,0.0104000
amber-ffsb,n,PHE,HB3,0.0104000
amber-ffsb,n,PHE,CG,0.0031000
amber-ffsb,n,PHE,CD1,-0.1392000
amber-ffsb,n,PHE,HD1,0.1374000
amber-ffsb,n,PHE,CD2,-0.1391000
amber-ffsb,n,PHE,HD2,0.1374000
amber-ffsb,n,PHE,CE1,-0.1602000
amber-ffsb,n,PHE,HE1,0.1433000
amber-ffsb,n,PHE,CE2,-0.1603000
amber-ffsb,n,PHE,HE2,0.1433000
amber-ffsb,n,PHE,CZ,-0.1208000
amber-ffsb,n,PHE,HZ,0.1329000
amber-ffsb,n,PHE,C,0.6123000
amber-ffsb,n,PHE,O,-0.5713000
amber-ffsb,c,PHE,N,-0.3821000
amber-ffsb,c,PHE,H,0.2681000
amber-ffsb,c,PHE,CA,-0.1825000
amber-ffsb,c,PHE,HA,0.1098000
amber-ffsb,c,PHE,CB,-0.0959000
amber-ffsb,c,PHE,HB2,0.0443000
amber-ffsb,c,PHE,HB3,0.0443000
amber-ffsb,c,PHE,CG,0.0552000
amber-ffsb,c,PHE,CD1,-0.1300000
amber-ffsb,c,PHE,HD1,0.1408000
amber-ffsb,c,PHE,CD2,-0.1300000
amber-ffsb,c,PHE,HD2,0.1408000
amber-ffsb,c,PHE,CE1,-0.1847000
amber-ffsb,c,PHE,HE1,0.1461000
amber-ffsb,c,PHE,CE2,-0.1847000
amber-ffsb,c,PHE,HE2,0.1461000
amber-ffsb,c,PHE,CZ,-0.0944000
amber-ffsb,c,PHE,HZ,0.1280000
amber-ffsb,c,PHE,C,0.7660000
amber-ffsb,c,PHE,O,-0.8026000
amber-ffsb,c,PHE,OXT,-0.8026000
amber-ffsb,n-,PHE,N,-0.6342000
amber-ffsb,n-,PHE,H1,0.1921000
amber-ffsb,n-,PHE,H2,0.1921000
amber-ffsb,n-,PHE,CA,0.0733000
amber-ffsb,n-,PHE,HA,0.1041000
amber-ffsb,n-,PHE,CB,0.0330000
amber-ffsb,n-,PHE,HB2,0.0104000
amber-ffsb,n-,PHE,HB3,0.0104000
amber-ffsb,n-,PHE,CG,0.0031000
amber-ffsb,n-,PHE,CD1,-0.1392000
amber-ffsb,n-,PHE,HD1,0.1374000
amber-ffsb,n-,PHE,CD2,-0.1391000
amber-ffsb,n-,PHE,HD2,0.1374000
amber-ffsb,n-,PHE,CE1,-0.1602000
amber-ffsb,n-,PHE,HE1,0.1433000
amber-ffsb,n-,PHE,CE2,-0.1603000
amber-ffsb,n-,PHE,HE2,0.1433000
amber-ffsb,n-,PHE,CZ,-0.1208000
amber-ffsb,n-,PHE,HZ,0.1329000
amber-ffsb,n-,PHE,C,0.6123000
amber-ffsb,n-,PHE,O,-0.5713000
amber-ffsb,c+,PHE,N,-0.3821000
amber-ffsb,c+,PHE,H,0.2681000
amber-ffsb,c+,PHE,CA,-0.1825000
amber-ffsb,c+,PHE,HA,0.1098000
amber-ffsb,c+,PHE,CB,-0.0959000
amber-ffsb,c+,PHE,HB2,0.0443000
amber-ffsb,c+,PHE,HB3,0.0443000
amber-ffsb,c+,PHE,CG,0.0552000
amber-ffsb,c+,PHE,CD1,-0.1300000
amber-ffsb,c+,PHE,HD1,0.1408000
amber-ffsb,c+,PHE,CD2,-0.1300000
amber-ffsb,c+,PHE,HD2,0.1408000
amber-ffsb,c+,PHE,CE1,-0.1847000
amber-ffsb,c+,PHE,HE1,0.1461000
amber-ffsb,c+,PHE,CE2,-0.1847000
amber-ffsb,c+,PHE,HE2,0.1461000
amber-ffsb,c+,PHE,CZ,-0.0944000
amber-ffsb,c+,PHE,HZ,0.1280000
amber-ffsb,c+,PHE,C,0.7660000
amber-ffsb,c+,PHE,O,-0.5351000
amber-ffsb,c+,PHE,OXT,-0.5351000
amber-ffsb,c+,PHE,HOXT,0.4650000
amber-ffsb,m,PRO,N,-0.2548000
amber-ffsb,m,PRO,CA,-0.0266000
amber-ffsb,m,PRO,CB,-0.0070000
amber-ffsb,m,PRO,CG,0.0189000
amber-ffsb,m,PRO,CD,0.0192000
amber-ffsb,m,PRO,HA,0.0641000
amber-ffsb,m,PRO,HB2,0.0253000
amber-ffsb,m,PRO,HB3,0.0253000
amber-ffsb,m,PRO,HG2,0.0213000
amber-ffsb,m,PRO,HG3,0.0213000
amber-ffsb,m,PRO,HD2,0.0391000
amber-ffsb,m,PRO,HD3,0.0391000
amber-ffsb,m,PRO,C,0.5896000
amber-ffsb,m,PRO,O,-0.5748000
amber-ffsb,n,PRO,N,-0.2020000
amber-ffsb,n,PRO,H2,0.3120000
amber-ffsb,n,PRO,H3,0.3120000
amber-ffsb,n,PRO,CA,0.1000000
amber-ffsb,n,PRO,CB,-0.1150000
amber-ffsb,n,PRO,CG,-0.1210000
amber-ffsb,n,PRO,CD,-0.0120000
amber-ffsb,n,PRO,HA,0.1000000
amber-ffsb,n,PRO,HB2,0.1000000
amber-ffsb,n,PRO,HB3,0.1000000
amber-ffsb,n,PRO,HG2,0.1000000
amber-ffsb,n,PRO,HG3,0.1000000
amber-ffsb,n,PRO,HD2,0.1000000
amber-ffsb,n,PRO,HD3,0.1000000
amber-ffsb,n,PRO,C,0.5260000
amber-ffsb,n,PRO,O,-0.5000000
amber-ffsb,c,PRO,N,-0.2802000
amber-ffsb,c,PRO,CA,-0.1336000
amber-ffsb,c,PRO,CB,-0.0543000
amber-ffsb,c,PRO,CG,0.0466000
amber-ffsb,c,PRO,CD,0.0434000
amber-ffsb,c,PRO,HA,0.0776000
amber-ffsb,c,PRO,HB2,0.0381000
amber-ffsb,c,PRO,HB3,0.0381000
amber-ffsb,c,PRO,HG2,0.0172000
amber-ffsb,c,PRO,HG3,0.0172000
amber-ffsb,c,PRO,HD2,0.0331000
amber-ffsb,c,PRO,HD3,0.0331000
amber-ffsb,c,PRO,C,0.6631000
amber-ffsb,c,PRO,O,-0.7697000
amber-ffsb,c,PRO,OXT,-0.7697000
amber-ffsb,n-,PRO,N,-0.8900000
amber-ffsb,n-,PRO,H2,0.3120000
amber-ffsb,n-,PRO,CA,0.1000000
amber-ffsb,n-,PRO,CB,-0.1150000
amber-ffsb,n-,PRO,CG,-0.1210000
amber-ffsb,n-,PRO,CD,-0.0120000
amber-ffsb,n-,PRO,HA,0.1000000
amber-ffsb,n-,PRO,HB2,0.1000000
amber-ffsb,n-,PRO,HB3,0.1000000
amber-ffsb,n-,PRO,HG2,0.1000000
amber-ffsb,n-,PRO,HG3,0.1000000
amber-ffsb,n-,PRO,HD2,0.1000000
amber-ffsb,n-,PRO,HD3,0.1000000
amber-ffsb,n-,PRO,C,0.5260000
amber-ffsb,n-,PRO,O,-0.5000000
amber-ffsb,c+,PRO,N,-0.2802000
amber-ffsb,c+,PRO,CA,-0.1336000
amber-ffsb,c+,PRO,CB,-0.0543000
amber-ffsb,c+,PRO,CG,0.0466000
amber-ffsb,c+,PRO,CD,0.0434000
amber-ffsb,c+,PRO,HA,0.0776000
amber-ffsb,c+,PRO,HB2,0.0381000
amber-ffsb,c+,PRO,HB3,0.0381000
amber-ffsb,c+,PRO,HG2,0.0172000
amber-ffsb,c+,PRO,HG3,0.0172000
amber-ffsb,c+,PRO,HD2,0.0331000
amber-ffsb,c+,PRO,HD3,0.0331000
amber-ffsb,c+,PRO,C,0.7087000
amber-ffsb,c+,PRO,O,-0.5500000
amber-ffsb,c+,PRO,OXT,-0.5000000
amber-ffsb,c+,PRO,HOXT,0.4650000
amber-ffsb,m,SER,N,-0.4157000
amber-ffsb,m,SER,H,0.2719000
amber-ffsb,m,SER,CA,-0.0249000
amber-ffsb,m,SER,HA,0.0843000
amber-ffsb,m,SER,CB,0.2117000
amber-ffsb,m,SER,HB2,0.0352000
amber-ffsb,m,SER,HB3,0.0352000
amber-ffsb,m,SER,OG,-0.6546000
amber-ffsb,m,SER,HG,0.4275000
amber-ffsb,m,SER,C,0.5973000
amber-ffsb,m,SER,O,-0.5679000
amber-ffsb,n,SER,N,0.1849000
amber-ffsb,n,SER,H1,0.1898000
amber-ffsb,n,SER,H2,0.1898000
amber-ffsb,n,SER,H3,0.1898000
amber-ffsb,n,SER,CA,0.0567000
amber-ffsb,n,SER,HA,0.0782000
amber-ffsb,n,SER,CB,0.2596000
amber-ffsb,n,SER,HB2,0.0273000
amber-ffsb,n,SER,HB3,0.0273000
amber-ffsb,n,SER,OG,-0.6714000
amber-ffsb,n,SER,HG,0.4239000
amber-ffsb,n,SER,C,0.6163000
amber-ffsb,n,SER,O,-0.5722000
amber-ffsb,c,SER,N,-0.3821000
amber-ffsb,c,SER,H,0.2681000
amber-ffsb,c,SER,CA,-0.2722000
amber-ffsb,c,SER,HA,0.1304000
amber-ffsb,c,SER,CB,0.1123000
amber-ffsb,c,SER,HB2,0.0813000
amber-ffsb,c,SER,HB3,0.0813000
amber-ffsb,c,SER,OG,-0.6514000
amber-ffsb,c,SER,HG,0.4474000
amber-ffsb,c,SER,C,0.8113000
amber-ffsb,c,SER,O,-0.8132000
amber-ffsb,c,SER,OXT,-0.8132000
amber-ffsb,n-,SER,N,-0.6253000
amber-ffsb,n-,SER,H1,0.1898000
amber-ffsb,n-,SER,H2,0.1898000
amber-ffsb,n-,SER,CA,0.0567000
amber-ffsb,n-,SER,HA,0.0782000
amber-ffsb,n-,SER,CB,0.2596000
amber-ffsb,n-,SER,HB2,0.0273000
amber-ffsb,n-,SER,HB3,0.0273000
amber-ffsb,n-,SER,OG,-0.6714000
amber-ffsb,n-,SER,HG,0.4239000
amber-ffsb,n-,SER,C,0.6163000
amber-ffsb,n-,SER,O,-0.5722000
amber-ffsb,c+,SER,N,-0.3821000
amber-ffsb,c+,SER,H,0.2681000
amber-ffsb,c+,SER,CA,-0.2722000
amber-ffsb,c+,SER,HA,0.1304000
amber-ffsb,c+,SER,CB,0.1123000
amber-ffsb,c+,SER,HB2,0.0813000
amber-ffsb,c+,SER,HB3,0.0813000
amber-ffsb,c+,SER,OG,-0.6514000
amber-ffsb,c+,SER,HG,0.4474000
amber-ffsb,c+,SER,C,0.8113000
amber-ffsb,c+,SER,O,-0.5457000
amber-ffsb,c+,SER,OXT,-0.5457000
amber-ffsb,c+,SER,HOXT,0.4650000
amber-ffsb,m,THR,N,-0.4157000
amber-ffsb,m,THR,H,0.2719000
amber-ffsb,m,THR,CA,-0.0389000
amber-ffsb,m,THR,HA,0.1007000
amber-ffsb,m,THR,CB,0.3654000
amber-ffsb,m,THR,HB,0.0043000
amber-ffsb,m,THR,OG1,-0.6761000
amber-ffsb,m,THR,HG1,0.4102000
amber-ffsb,m,THR,CG2,-0.2438000
amber-ffsb,m,THR,HG21,0.0642000
amber-ffsb,m,THR,HG22,0.0642000
amber-ffsb,m,THR,HG23,0.0642000
amber-ffsb,m,THR,C,0.5973000
amber-ffsb,m,THR,O,-0.5679000
amber-ffsb,n,THR,N,0.1812000
amber-ffsb,n,THR,H1,0.1934000
amber-ffsb,n,THR,H2,0.1934000
amber-ffsb,n,THR,H3,0.1934000
amber-ffsb,n,THR,CA,0.0034000
amber-ffsb,n,THR,HA,0.1087000
amber-ffsb,n,THR,CB,0.4514000
amber-ffsb,n,THR,HB,-0.0323000
amber-ffsb,n,THR,OG1,-0.6764000
amber-ffsb,n,THR,HG1,0.4070000
amber-ffsb,n,THR,CG2,-0.2554000
amber-ffsb,n,THR,HG21,0.0627000
amber-ffsb,n,THR,HG22,0.0627000
amber-ffsb,n,THR,HG23,0.0627000
amber-ffsb,n,THR,C,0.6163000
amber-ffsb,n,THR,O,-0.5722000
amber-ffsb,c,THR,N,-0.3821000
amber-ffsb,c,THR,H,0.2681000
amber-ffsb,c,THR,CA,-0.2420000
amber-ffsb,c,THR,HA,0.1207000
amber-ffsb,c,THR,CB,0.3025000
amber-ffsb,c,THR,HB,0.0078000
amber-ffsb,c,THR,OG1,-0.6496000
amber-ffsb,c,THR,HG1,0.4119000
amber-ffsb,c,THR,CG2,-0.1853000
amber-ffsb,c,THR,HG21,0.0586000
amber-ffsb,c,THR,HG22,0.0586000
amber-ffsb,c,THR,HG23,0.0586000
amber-ffsb,c,THR,C,0.7810000
amber-ffsb,c,THR,O,-0.8044000
amber-ffsb,c,THR,OXT,-0.8044000
amber-ffsb,n-,THR,N,-0.6254000
amber-ffsb,n-,THR,H1,0.1934000
amber-ffsb,n-,THR,H2,0.1934000
amber-ffsb,n-,THR,CA,0.0034000
amber-ffsb,n-,THR,HA,0.1087000
amber-ffsb,n-,THR,CB,0.4514000
amber-ffsb,n-,THR,HB,-0.0323000
amber-ffsb,n-,THR,OG1,-0.6764000
amber-ffsb,n-,THR,HG1,0.4070000
amber-ffsb,n-,THR,CG2,-0.2554000
amber-ffsb,n-,THR,HG21,0.0627000
amber-ffsb,n-,THR,HG22,0.0627000
amber-ffsb,n-,THR,HG23,0.0627000
amber-ffsb,n-,THR,C,0.6163000
amber-ffsb,n-,THR,O,-0.5722000
amber-ffsb,c+,THR,N,-0.3821000
amber-ffsb,c+,THR,H,0.2681000
amber-ffsb,c+,THR,CA,-0.2420000
amber-ffsb,c+,THR,HA,0.1207000
amber-ffsb,c+,THR,CB,0.3025000
amber-ffsb,c+,THR,HB,0.0078000
amber-ffsb,c+,THR,OG1,-0.6496000
amber-ffsb,c+,THR,HG1,0.4119000
amber-ffsb,c+,THR,CG2,-0.1853000
amber-ffsb,c+,THR,HG21,0.0586000
amber-ffsb,c+,THR,HG22,0.0586000
amber-ffsb,c+,THR,HG23,0.0586000
amber-ffsb,c+,THR,C,0.7810000
amber-ffsb,c+,THR,O,-0.5369000
amber-ffsb,c+,THR,OXT,-0.5369000
amber-ffsb,c+,THR,HOXT,0.4650000
amber-ffsb,m,TRP,N,-0.4157000
amber-ffsb,m,TRP,H,0.2719000
amber-ffsb,m,TRP,CA,-0.0275000
amber-ffsb,m,TRP,HA,0.1123000
amber-ffsb,m,TRP,CB,-0.0050000
amber-ffsb,m,TRP,HB2,0.0339000
amber-ffsb,m,TRP,HB3,0.0339000
amber-ffsb,m,TRP,CG,-0.1415000
amber-ffsb,m,TRP,CD1,-0.1638000
amber-ffsb,m,TRP,HD1,0.2062000
amber-ffsb,m,TRP,NE1,-0.3418000
amber-ffsb,m,TRP,HE1,0.3412000
amber-ffsb,m,TRP,CE2,0.1380000
amber-ffsb,m,TRP,CD2,0.1243000
amber-ffsb,m,TRP,CE3,-0.2387000
amber-ffsb,m,TRP,HE3,0.1700000
amber-ffsb,m,TRP,CZ2,-0.2601000
amber-ffsb,m,TRP,HZ2,0.1572000
amber-ffsb,m,TRP,CZ3,-0.1972000
amber-ffsb,m,TRP,HZ3,0.1447000
amber-ffsb,m,TRP,CH2,-0.1134000
amber-ffsb,m,TRP,HH2,0.1417000
amber-ffsb,m,TRP,C,0.5973000
amber-ffsb,m,TRP,O,-0.5679000
amber-ffsb,n,TRP,N,0.1913000
amber-ffsb,n,TRP,H1,0.1888000
amber-ffsb,n,TRP,H2,0.1888000
amber-ffsb,n,TRP,H3,0.1888000
amber-ffsb,n,TRP,CA,0.0421000
amber-ffsb,n,TRP,HA,0.1162000
amber-ffsb,n,TRP,CB,0.0543000
amber-ffsb,n,TRP,HB2,0.0222000
amber-ffsb,n,TRP,HB3,0.0222000
amber-ffsb,n,TRP,CG,-0.1654000
amber-ffsb,n,TRP,CD1,-0.1788000
amber-ffsb,n,TRP,HD1,0.2195000
amber-ffsb,n,TRP,NE1,-0.3444000
amber-ffsb,n,TRP,HE1,0.3412000
amber-ffsb,n,TRP,CE2,0.1575000
amber-ffsb,n,TRP,CD2,0.1132000
amber-ffsb,n,TRP,CE3,-0.2265000
amber-ffsb,n,TRP,HE3,0.1646000
amber-ffsb,n,TRP,CZ2,-0.2710000
amber-ffsb,n,TRP,HZ2,0.1589000
amber-ffsb,n,TRP,CZ3,-0.2034000
amber-ffsb,n,TRP,HZ3,0.1458000
amber-ffsb,n,TRP,CH2,-0.1080000
amber-ffsb,n,TRP,HH2,0.1411000
amber-ffsb,n,TRP,C,0.6123000
amber-ffsb,n,TRP,O,-0.5713000
amber-ffsb,c,TRP,N,-0.3821000
amber-ffsb,c,TRP,H,0.2681000
amber-ffsb,c,TRP,CA,-0.2084000
amber-ffsb,c,TRP,HA,0.1272000
amber-ffsb,c,TRP,CB,-0.0742000
amber-ffsb,c,TRP,HB2,0.0497000
amber-ffsb,c,TRP,HB3,0.0497000
amber-ffsb,c,TRP,CG,-0.0796000
amber-ffsb,c,TRP,CD1,-0.1808000
amber-ffsb,c,TRP,HD1,0.2043000
amber-ffsb,c,TRP,NE1,-0.3316000
amber-ffsb,c,TRP,HE1,0.3413000
amber-ffsb,c,TRP,CE2,0.1222000
amber-ffsb,c,TRP,CD2,0.1078000
amber-ffsb,c,TRP,CE3,-0.1837000
amber-ffsb,c,TRP,HE3,0.1491000
amber-ffsb,c,TRP,CZ2,-0.2594000
amber-ffsb,c,TRP,HZ2,0.1567000
amber-ffsb,c,TRP,CZ3,-0.2287000
amber-ffsb,c,TRP,HZ3,0.1507000
amber-ffsb,c,TRP,CH2,-0.1020000
amber-ffsb,c,TRP,HH2,0.1401000
amber-ffsb,c,TRP,C,0.7658000
amber-ffsb,c,TRP,O,-0.8011000
amber-ffsb,c,TRP,OXT,-0.8011000
amber-ffsb,n-,TRP,N,-0.6199000
amber-ffsb,n-,TRP,H1,0.1888000
amber-ffsb,n-,TRP,H2,0.1888000
amber-ffsb,n-,TRP,CA,0.0421000
amber-ffsb,n-,TRP,HA,0.1162000
amber-ffsb,n-,TRP,CB,0.0543000
amber-ffsb,n-,TRP,HB2,0.0222000
amber-ffsb,n-,TRP,HB3,0.0222000
amber-ffsb,n-,TRP,CG,-0.1654000
amber-ffsb,n-,TRP,CD1,-0.1788000
amber-ffsb,n-,TRP,HD1,0.2195000
amber-ffsb,n-,TRP,NE1,-0.3444000
amber-ffsb,n-,TRP,HE1,0.3412000
amber-ffsb,n-,TRP,CE2,0.1575000
amber-ffsb,n-,TRP,CD2,0.1132000
amber-ffsb,n-,TRP,CE3,-0.2265000
amber-ffsb,n-,TRP,HE3,0.1646000
amber-ffsb,n-,TRP,CZ2,-0.2710000
amber-ffsb,n-,TRP,HZ2,0.1589000
amber-ffsb,n-,TRP,CZ3,-0.2034000
amber-ffsb,n-,TRP,HZ3,0.1458000
amber-ffsb,n-,TRP,CH2,-0.1080000
amber-ffsb,n-,TRP,HH2,0.1411000
amber-ffsb,n-,TRP,C,0.6123000
amber-ffsb,n-,TRP,O,-0.5713000
amber-ffsb,c+,TRP,N,-0.3821000
amber-ffsb,c+,TRP,H,0.2681000
amber-ffsb,c+,TRP,CA,-0.2084000
amber-ffsb,c+,TRP,HA,0.1272000
amber-ffsb,c+,TRP,CB,-0.0742000
amber-ffsb,c+,TRP,HB2,0.0497000
amber-ffsb,c+,TRP,HB3,0.0497000
amber-ffsb,c+,TRP,CG,-0.0796000
amber-ffsb,c+,TRP,CD1,-0.1808000
amber-ffsb,c+,TRP,HD1,0.2043000
amber-ffsb,c+,TRP,NE1,-0.3316000
amber-ffsb,c+,TRP,HE1,0.3413000
amber-ffsb,c+,TRP,CE2,0.1222000
amber-ffsb,c+,TRP,CD2,0.1078000
amber-ffsb,c+,TRP,CE3,-0.1837000
amber-ffsb,c+,TRP,HE3,0.1491000
amber-ffsb,c+,TRP,CZ2,-0.2594000
amber-ffsb,c+,TRP,HZ2,0.1567000
amber-ffsb,c+,TRP,CZ3,-0.2287000
amber-ffsb,c+,TRP,HZ3,0.1507000
amber-ffsb,c+,TRP,CH2,-0.1020000
amber-ffsb,c+,TRP,HH2,0.1401000
amber-ffsb,c+,TRP,C,0.7658000
amber-ffsb,c+,TRP,O,-0.5336000
amber-ffsb,c+,TRP,OXT,-0.5336000
amber-ffsb,c+,TRP,HOXT,0.4650000
amber-ffsb,m,TYR,N,-0.4157000
amber-ffsb,m,TYR,H,0.2719000
amber-ffsb,m,TYR,CA,-0.0014000
amber-ffsb,m,TYR,HA,0.0876000
amber-ffsb,m,TYR,CB,-0.0152000
amber-ffsb,m,TYR,HB2,0.0295000
amber-ffsb,m,TYR,HB3,0.0295000
amber-ffsb,m,TYR,CG,-0.0011000
amber-ffsb,m,TYR,CD1,-0.1906000
amber-ffsb,m,TYR,HD1,0.1699000
amber-ffsb,m,TYR,CE1,-0.2341000
amber-ffsb,m,TYR,HE1,0.1656000
amber-ffsb,m,TYR,CD2,-0.1906000
amber-ffsb,m,TYR,HD2,0.1699000
amber-ffsb,m,TYR,CE2,-0.2341000
amber-ffsb,m,TYR,HE2,0.1656000
amber-ffsb,m,TYR,CZ,0.3226000
amber-ffsb,m,TYR,OH,-0.5579000
amber-ffsb,m,TYR,HH,0.3992000
amber-ffsb,m,TYR,C,0.5973000
amber-ffsb,m,TYR,O,-0.5679000
amber-ffsb,n,TYR,N,0.1940000
amber-ffsb,n,TYR,H1,0.1873000
amber-ffsb,n,TYR,H2,0.1873000
amber-ffsb,n,TYR,H3,0.1873000
amber-ffsb,n,TYR,CA,0.0570000
amber-ffsb,n,TYR,HA,0.0983000
amber-ffsb,n,TYR,CB,0.0659000
amber-ffsb,n,TYR,HB2,0.0102000
amber-ffsb,n,TYR,HB3,0.0102000
amber-ffsb,n,TYR,CG,-0.0205000
amber-ffsb,n,TYR,CD1,-0.2002000
amber-ffsb,n,TYR,HD1,0.1720000
amber-ffsb,n,TYR,CE1,-0.2239000
amber-ffsb,n,TYR,HE1,0.1650000
amber-ffsb,n,TYR,CD2,-0.2002000
amber-ffsb,n,TYR,HD2,0.1720000
amber-ffsb,n,TYR,CE2,-0.2239000
amber-ffsb,n,TYR,HE2,0.1650000
amber-ffsb,n,TYR,CZ,0.3139000
amber-ffsb,n,TYR,OH,-0.5578000
amber-ffsb,n,TYR,HH,0.4001000
amber-ffsb,n,TYR,C,0.6123000
amber-ffsb,n,TYR,O,-0.5713000
amber-ffsb,c,TYR,N,-0.3821000
amber-ffsb,c,TYR,H,0.2681000
amber-ffsb,c,TYR,CA,-0.2015000
amber-ffsb,c,TYR,HA,0.1092000
amber-ffsb,c,TYR,CB,-0.0752000
amber-ffsb,c,TYR,HB2,0.0490000
amber-ffsb,c,TYR,HB3,0.0490000
amber-ffsb,c,TYR,CG,0.0243000
amber-ffsb,c,TYR,CD1,-0.1922000
amber-ffsb,c,TYR,HD1,0.1780000
amber-ffsb,c,TYR,CE1,-0.2458000
amber-ffsb,c,TYR,HE1,0.1673000
amber-ffsb,c,TYR,CD2,-0.1922000
amber-ffsb,c,TYR,HD2,0.1780000
amber-ffsb,c,TYR,CE2,-0.2458000
amber-ffsb,c,TYR,HE2,0.1673000
amber-ffsb,c,TYR,CZ,0.3395000
amber-ffsb,c,TYR,OH,-0.5643000
amber-ffsb,c,TYR,HH,0.4017000
amber-ffsb,c,TYR,C,0.7817000
amber-ffsb,c,TYR,O,-0.8070000
amber-ffsb,c,TYR,OXT,-0.8070000
amber-ffsb,n-,TYR,N,-0.6187000
amber-ffsb,n-,TYR,H1,0.1873000
amber-ffsb,n-,TYR,H2,0.1873000
amber-ffsb,n-,TYR,CA,0.0570000
amber-ffsb,n-,TYR,HA,0.0983000
amber-ffsb,n-,TYR,CB,0.0659000
amber-ffsb,n-,TYR,HB2,0.0102000
amber-ffsb,n-,TYR,HB3,0.0102000
amber-ffsb,n-,TYR,CG,-0.0205000
amber-ffsb,n-,TYR,CD1,-0.2002000
amber-ffsb,n-,TYR,HD1,0.1720000
amber-ffsb,n-,TYR,CE1,-0.2239000
amber-ffsb,n-,TYR,HE1,0.1650000
amber-ffsb,n-,TYR,CD2,-0.2002000
amber-ffsb,n-,TYR,HD2,0.1720000
amber-ffsb,n-,TYR,CE2,-0.2239000
amber-ffsb,n-,TYR,HE2,0.1650000
amber-ffsb,n-,TYR,CZ,0.3139000
amber-ffsb,n-,TYR,OH,-0.5578000
amber-ffsb,n-,TYR,HH,0.4001000
amber-ffsb,n-,TYR,C,0.6123000
amber-ffsb,n-,TYR,O,-0.5713000
amber-ffsb,c+,TYR,N,-0.3821000
amber-ffsb,c+,TYR,H,0.2681000
amber-ffsb,c+,TYR,CA,-0.2015000
amber-ffsb,c+,TYR,HA,0.1092000
amber-ffsb,c+,TYR,CB,-0.0752000
amber-ffsb,c+,TYR,HB2,0.0490000
amber-ffsb,c+,TYR,HB3,0.0490000
amber-ffsb,c+,TYR,CG,0.0243000
amber-ffsb,c+,TYR,CD1,-0.1922000
amber-ffsb,c+,TYR,HD1,0.1780000
amber-ffsb,c+,TYR,CE1,-0.2458000
amber-ffsb,c+,TYR,HE1,0.1673000
amber-ffsb,c+,TYR,CD2,-0.1922000
amber-ffsb,c+,TYR,HD2,0.1780000
amber-ffsb,c+,TYR,CE2,-0.2458000
amber-ffsb,c+,TYR,HE2,0.1673000
amber-ffsb,c+,TYR,CZ,0.3395000
amber-ffsb,c+,TYR,OH,-0.5643000
amber-ffsb,c+,TYR,HH,0.4017000
amber-ffsb,c+,TYR,C,0.8817000
amber-ffsb,c+,TYR,O,-0.7070000
amber-ffsb,c+,TYR,OXT,-0.4720000
amber-ffsb,c+,TYR,HOXT,0.4650000
amber-ffsb,m,TYM,N,-0.4157000
amber-ffsb,m,TYM,H,0.2719000
amber-ffsb,m,TYM,CA,-0.0014000
amber-ffsb,m,TYM,HA,0.0876000
amber-ffsb,m,TYM,CB,-0.0152000
amber-ffsb,m,TYM,HB2,0.0295000
amber-ffsb,m,TYM,HB3,0.0295000
amber-ffsb,m,TYM,CG,-0.0511000
amber-ffsb,m,TYM,CD1,-0.2160000
amber-ffsb,m,TYM,HD1,0.1699000
amber-ffsb,m,TYM,CE1,-0.2841000
amber-ffsb,m,TYM,HE1,0.1656000
amber-ffsb,m,TYM,CD2,-0.2160000
amber-ffsb,m,TYM,HD2,0.1699000
amber-ffsb,m,TYM,CE2,-0.2841000
amber-ffsb,m,TYM,HE2,0.1656000
amber-ffsb,m,TYM,CZ,0.3226000
amber-ffsb,m,TYM,OH,-0.9579000
amber-ffsb,m,TYM,C,0.5973000
amber-ffsb,m,TYM,O,-0.5679000
amber-ffsb,n,TYM,N,0.1940000
amber-ffsb,n,TYM,H1,0.1873000
amber-ffsb,n,TYM,H2,0.1873000
amber-ffsb,n,TYM,H3,0.1873000
amber-ffsb,n,TYM,CA,0.0570000
amber-ffsb,n,TYM,HA,0.0983000
amber-ffsb,n,TYM,CB,-0.0152000
amber-ffsb,n,TYM,HB2,0.0295000
amber-ffsb,n,TYM,HB3,0.0295000
amber-ffsb,n,TYM,CG,-0.0511000
amber-ffsb,n,TYM,CD1,-0.2160000
amber-ffsb,n,TYM,HD1,0.1699000
amber-ffsb,n,TYM,CE1,-0.2841000
amber-ffsb,n,TYM,HE1,0.1656000
amber-ffsb,n,TYM,CD2,-0.2160000
amber-ffsb,n,TYM,HD2,0.1699000
amber-ffsb,n,TYM,CE2,-0.2841000
amber-ffsb,n,TYM,HE2,0.1656000
amber-ffsb,n,TYM,CZ,0.3226000
amber-ffsb,n,TYM,OH,-0.9383000
amber-ffsb,n,TYM,C,0.6123000
amber-ffsb,n,TYM,O,-0.5713000
amber-ffsb,c,TYM,N,-0.3821000
amber-ffsb,c,TYM,H,0.2681000
amber-ffsb,c,TYM,CA,-0.2015000
amber-ffsb,c,TYM,HA,0.1092000
amber-ffsb,c,TYM,CB,-0.0152000
amber-ffsb,c,TYM,HB2,0.0295000
amber-ffsb,c,TYM,HB3,0.0295000
amber-ffsb,c,TYM,CG,-0.0511000
amber-ffsb,c,TYM,CD1,-0.2160000
amber-ffsb,c,TYM,HD1,0.1699000
amber-ffsb,c,TYM,CE1,-0.2841000
amber-ffsb,c,TYM,HE1,0.1656000
amber-ffsb,c,TYM,CD2,-0.2160000
amber-ffsb,c,TYM,HD2,0.1699000
amber-ffsb,c,TYM,CE2,-0.2841000
amber-ffsb,c,TYM,HE2,0.1656000
amber-ffsb,c,TYM,CZ,0.3226000
amber-ffsb,c,TYM,OH,-0.9475000
amber-ffsb,c,TYM,C,0.7817000
amber-ffsb,c,TYM,O,-0.8070000
amber-ffsb,c,TYM,OXT,-0.8070000
amber-ffsb,n-,TYM,N,-0.6187000
amber-ffsb,n-,TYM,H1,0.1873000
amber-ffsb,n-,TYM,H2,0.1873000
amber-ffsb,n-,TYM,CA,0.0570000
amber-ffsb,n-,TYM,HA,0.0983000
amber-ffsb,n-,TYM,CB,-0.0152000
amber-ffsb,n-,TYM,HB2,0.0295000
amber-ffsb,n-,TYM,HB3,0.0295000
amber-ffsb,n-,TYM,CG,-0.0511000
amber-ffsb,n-,TYM,CD1,-0.2160000
amber-ffsb,n-,TYM,HD1,0.1699000
amber-ffsb,n-,TYM,CE1,-0.2841000
amber-ffsb,n-,TYM,HE1,0.1656000
amber-ffsb,n-,TYM,CD2,-0.2160000
amber-ffsb,n-,TYM,HD2,0.1699000
amber-ffsb,n-,TYM,CE2,-0.2841000
amber-ffsb,n-,TYM,HE2,0.1656000
amber-ffsb,n-,TYM,CZ,0.3226000
amber-ffsb,n-,TYM,OH,-0.9383000
amber-ffsb,n-,TYM,C,0.6123000
amber-ffsb,n-,TYM,O,-0.5713000
amber-ffsb,c+,TYM,N,-0.3821000
amber-ffsb,c+,TYM,H,0.2681000
amber-ffsb,c+,TYM,CA,-0.2015000
amber-ffsb,c+,TYM,HA,0.1092000
amber-ffsb,c+,TYM,CB,-0.0152000
amber-ffsb,c+,TYM,HB2,0.0295000
amber-ffsb,c+,TYM,HB3,0.0295000
amber-ffsb,c+,TYM,CG,-0.0511000
amber-ffsb,c+,TYM,CD1,-0.2160000
amber-ffsb,c+,TYM,HD1,0.1699000
amber-ffsb,c+,TYM,CE1,-0.2841000
amber-ffsb,c+,TYM,HE1,0.1656000
amber-ffsb,c+,TYM,CD2,-0.2160000
amber-ffsb,c+,TYM,HD2,0.1699000
amber-ffsb,c+,TYM,CE2,-0.2841000
amber-ffsb,c+,TYM,HE2,0.1656000
amber-ffsb,c+,TYM,CZ,0.3226000
amber-ffsb,c+,TYM,OH,-0.9475000
amber-ffsb,c+,TYM,C,0.7817000
amber-ffsb,c+,TYM,O,-0.5395000
amber-ffsb,c+,TYM,OXT,-0.5395000
amber-ffsb,c+,TYM,HOXT,0.4650000
amber-ffsb,m,VAL,N,-0.4157000
amber-ffsb,m,VAL,H,0.2719000
amber-ffsb,m,VAL,CA,-0.0875000
amber-ffsb,m,VAL,HA,0.0969000
amber-ffsb,m,VAL,CB,0.2985000
amber-ffsb,m,VAL,HB,-0.0297000
amber-ffsb,m,VAL,CG1,-0.3192000
amber-ffsb,m,VAL,HG11,0.0791000
amber-ffsb,m,VAL,HG12,0.0791000
amber-ffsb,m,VAL,HG13,0.0791000
amber-ffsb,m,VAL,CG2,-0.3192000
amber-ffsb,m,VAL,HG21,0.0791000
amber-ffsb,m,VAL,HG22,0.0791000
amber-ffsb,m,VAL,HG23,0.0791000
amber-ffsb,m,VAL,C,0.5973000
amber-ffsb,m,VAL,O,-0.5679000
amber-ffsb,n,VAL,N,0.0577000
amber-ffsb,n,VAL,H1,0.2272000
amber-ffsb,n,VAL,H2,0.2272000
amber-ffsb,n,VAL,H3,0.2272000
amber-ffsb,n,VAL,CA,-0.0054000
amber-ffsb,n,VAL,HA,0.1093000
amber-ffsb,n,VAL,CB,0.3196000
amber-ffsb,n,VAL,HB,-0.0221000
amber-ffsb,n,VAL,CG1,-0.3129000
amber-ffsb,n,VAL,HG11,0.0735000
amber-ffsb,n,VAL,HG12,0.0735000
amber-ffsb,n,VAL,HG13,0.0735000
amber-ffsb,n,VAL,CG2,-0.3129000
amber-ffsb,n,VAL,HG21,0.0735000
amber-ffsb,n,VAL,HG22,0.0735000
amber-ffsb,n,VAL,HG23,0.0735000
amber-ffsb,n,VAL,C,0.6163000
amber-ffsb,n,VAL,O,-0.5722000
amber-ffsb,c,VAL,N,-0.3821000
amber-ffsb,c,VAL,H,0.2681000
amber-ffsb,c,VAL,CA,-0.3438000
amber-ffsb,c,VAL,HA,0.1438000
amber-ffsb,c,VAL,CB,0.1940000
amber-ffsb,c,VAL,HB,0.0308000
amber-ffsb,c,VAL,CG1,-0.3064000
amber-ffsb,c,VAL,HG11,0.0836000
amber-ffsb,c,VAL,HG12,0.0836000
amber-ffsb,c,VAL,HG13,0.0836000
amber-ffsb,c,VAL,CG2,-0.3064000
amber-ffsb,c,VAL,HG21,0.0836000
amber-ffsb,c,VAL,HG22,0.0836000
amber-ffsb,c,VAL,HG23,0.0836000
amber-ffsb,c,VAL,C,0.8350000
amber-ffsb,c,VAL,O,-0.8173000
amber-ffsb,c,VAL,OXT,-0.8173000
amber-ffsb,n-,VAL,N,-0.7151000
amber-ffsb,n-,VAL,H1,0.2272000
amber-ffsb,n-,VAL,H2,0.2272000
amber-ffsb,n-,VAL,CA,-0.0054000
amber-ffsb,n-,VAL,HA,0.1093000
amber-ffsb,n-,VAL,CB,0.3196000
amber-ffsb,n-,VAL,HB,-0.0221000
amber-ffsb,n-,VAL,CG1,-0.3129000
amber-ffsb,n-,VAL,HG11,0.0735000
amber-ffsb,n-,VAL,HG12,0.0735000
amber-ffsb,n-,VAL,HG13,0.0735000
amber-ffsb,n-,VAL,CG2,-0.3129000
amber-ffsb,n-,VAL,HG21,0.0735000
amber-ffsb,n-,VAL,HG22,0.0735000
amber-ffsb,n-,VAL,HG23,0.0735000
amber-ffsb,n-,VAL,C,0.6163000
amber-ffsb,n-,VAL,O,-0.5722000
amber-ffsb,c+,VAL,N,-0.3821000
amber-ffsb,c+,VAL,H,0.2681000
amber-ffsb,c+,VAL,CA,-0.3438000
amber-ffsb,c+,VAL,HA,0.1438000
amber-ffsb,c+,VAL,CB,0.1940000
amber-ffsb,c+,VAL,HB,0.0308000
amber-ffsb,c+,VAL,CG1,-0.3064000
amber-ffsb,c+,VAL,HG11,0.0836000
amber-ffsb,c+,VAL,HG12,0.0836000
amber-ffsb,c+,VAL,HG13,0.0836000
amber-ffsb,c+,VAL,CG2,-0.3064000
amber-ffsb,c+,VAL,HG21,0.0836000
amber-ffsb,c+,VAL,HG22,0.0836000
amber-ffsb,c+,VAL,HG23,0.0836000
amber-ffsb,c+,VAL,C,0.8350000
amber-ffsb,c+,VAL,O,-0.5498000
amber-ffsb,c+,VAL,OXT,-0.5498000
amber-ffsb,c+,VAL,HOXT,0.4650000
amber-ff03,m,ALA,N,-0.4047730
amber-ff03,m,ALA,H,0.2942760
amber-ff03,m,ALA,CA,-0.0277330
amber-ff03,m,ALA,HA,0.1208020
amber-ff03,m,ALA,CB,-0.2299510
amber-ff03,m,ALA,HB1,0.0774280
amber-ff03,m,ALA,HB2,0.0774280
amber-ff03,m,ALA,HB3,0.0774280
amber-ff03,m,ALA,C,0.5702240
amber-ff03,m,ALA,O,-0.5551290
amber-ff03,n,ALA,N,-0.5892660
amber-ff03,n,ALA,H1,0.4464220
amber-ff03,n,ALA,H2,0.4464220
amber-ff03,n,ALA,H3,0.4464220
amber-ff03,n,ALA,CA,0.1138710
amber-ff03,n,ALA,HA,0.0671500
amber-ff03,n,ALA,CB,-0.2041130
amber-ff03,n,ALA,HB1,0.0630560
amber-ff03,n,ALA,HB2,0.0630560
amber-ff03,n,ALA,HB3,0.0630560
amber-ff03,n,ALA,C,0.6766870
amber-ff03,n,ALA,O,-0.5927640
amber-ff03,c,ALA,N,-0.6222020
amber-ff03,c,ALA,H,0.3597840
amber-ff03,c,ALA,CA,-0.0541020
amber-ff03,c,ALA,HA,0.1232830
amber-ff03,c,ALA,CB,-0.1857180
amber-ff03,c,ALA,HB1,0.0696520
amber-ff03,c,ALA,HB2,0.0696520
amber-ff03,c,ALA,HB3,0.0696520
amber-ff03,c,ALA,C,0.6640140
amber-ff03,c,ALA,O,-0.7470070
amber-ff03,c,ALA,OXT,-0.7470070
amber-ff03,n-,ALA,N,-1.1428440
amber-ff03,n-,ALA,H1,0.4464220
amber-ff03,n-,ALA,H2,0.4464220
amber-ff03,n-,ALA,CA,0.1138710
amber-ff03,n-,ALA,HA,0.0671500
amber-ff03,n-,ALA,CB,-0.2041130
amber-ff03,n-,ALA,HB1,0.0630560
amber-ff03,n-,ALA,HB2,0.0630560
amber-ff03,n-,ALA,HB3,0.0630560
amber-ff03,n-,ALA,C,0.6766870
amber-ff03,n-,ALA,O,-0.5927640
amber-ff03,c+,ALA,N,-0.6222020
amber-ff03,c+,ALA,H,0.3597840
amber-ff03,c+,ALA,CA,-0.0541020
amber-ff03,c+,ALA,HA,0.1232830
amber-ff03,c+,ALA,CB,-0.1857180
amber-ff03,c+,ALA,HB1,0.0696520
amber-ff03,c+,ALA,HB2,0.0696520
amber-ff03,c+,ALA,HB3,0.0696520
amber-ff03,c+,ALA,C,0.6640140
amber-ff03,c+,ALA,O,-0.4708370
amber-ff03,c+,ALA,OXT,-0.4708370
amber-ff03,c+,ALA,HOXT,0.4476610
amber-ff03,m,ARG,N,-0.3008790
amber-ff03,m,ARG,H,0.2336930
amber-ff03,m,ARG,CA,-0.1313810
amber-ff03,m,ARG,HA,0.0532660
amber-ff03,m,ARG,CB,0.0367070
amber-ff03,m,ARG,HB2,0.0280120
amber-ff03,m,ARG,HB3,0.0280120
amber-ff03,m,ARG,CG,0.0124540
amber-ff03,m,ARG,HG2,0.0029640
amber-ff03,m,ARG,HG3,0.0029640
amber-ff03,m,ARG,CD,0.1263290
amber-ff03,m,ARG,HD2,0.0681480
amber-ff03,m,ARG,HD3,0.0681480
amber-ff03,m,ARG,NE,-0.4648900
amber-ff03,m,ARG,HE,0.3262740
amber-ff03,m,ARG,CZ,0.5655430
amber-ff03,m,ARG,NH1,-0.6857740
amber-ff03,m,ARG,HH11,0.3910520
amber-ff03,m,ARG,HH12,0.3910520
amber-ff03,m,ARG,NH2,-0.6857740
amber-ff03,m,ARG,HH21,0.3910520
amber-ff03,m,ARG,HH22,0.3910520
amber-ff03,m,ARG,C,0.7303080
amber-ff03,m,ARG,O,-0.5783320
amber-ff03,n,ARG,N,-0.6705150
amber-ff03,n,ARG,H1,0.4735050
amber-ff03,n,ARG,H2,0.4735050
amber-ff03,n,ARG,H3,0.4735050
amber-ff03,n,ARG,CA,0.0939030
amber-ff03,n,ARG,HA,0.0249980
amber-ff03,n,ARG,CB,0.0291710
amber-ff03,n,ARG,HB2,0.0287280
amber-ff03,n,ARG,HB3,0.0287280
amber-ff03,n,ARG,CG,-0.0162080
amber-ff03,n,ARG,HG2,0.0020440
amber-ff03,n,ARG,HG3,0.0020440
amber-ff03,n,ARG,CD,0.1765680
amber-ff03,n,ARG,HD2,0.0484770
amber-ff03,n,ARG,HD3,0.0484770
amber-ff03,n,ARG,NE,-0.4505680
amber-ff03,n,ARG,HE,0.3384670
amber-ff03,n,ARG,CZ,0.5613600
amber-ff03,n,ARG,NH1,-0.7064730
amber-ff03,n,ARG,HH11,0.4059270
amber-ff03,n,ARG,HH12,0.4059270
amber-ff03,n,ARG,NH2,-0.7064730
amber-ff03,n,ARG,HH21,0.4059270
amber-ff03,n,ARG,HH22,0.4059270
amber-ff03,n,ARG,C,0.7702840
amber-ff03,n,ARG,O,-0.6472340
amber-ff03,c,ARG,N,-0.4953400
amber-ff03,c,ARG,H,0.3138640
amber-ff03,c,ARG,CA,-0.1222650
amber-ff03,c,ARG,HA,0.0930730
amber-ff03,c,ARG,CB,0.0158200
amber-ff03,c,ARG,HB2,0.0403760
amber-ff03,c,ARG,HB3,0.0403760
amber-ff03,c,ARG,CG,0.0136970
amber-ff03,c,ARG,HG2,-0.0013660
amber-ff03,c,ARG,HG3,-0.0013660
amber-ff03,c,ARG,CD,0.1833240
amber-ff03,c,ARG,HD2,0.0486910
amber-ff03,c,ARG,HD3,0.0486910
amber-ff03,c,ARG,NE,-0.4686820
amber-ff03,c,ARG,HE,0.3430940
amber-ff03,c,ARG,CZ,0.5777840
amber-ff03,c,ARG,NH1,-0.7123180
amber-ff03,c,ARG,HH11,0.4062160
amber-ff03,c,ARG,HH12,0.4062160
amber-ff03,c,ARG,NH2,-0.7123180
amber-ff03,c,ARG,HH21,0.4062160
amber-ff03,c,ARG,HH22,0.4062160
amber-ff03,c,ARG,C,0.6487630
amber-ff03,c,ARG,O,-0.7393820
amber-ff03,c,ARG,OXT,-0.7393820
amber-ff03,n-,ARG,N,-1.1970100
amber-ff03,n-,ARG,H1,0.4735050
amber-ff03,n-,ARG,H2,0.4735050
amber-ff03,n-,ARG,CA,0.0939030
amber-ff03,n-,ARG,HA,0.0249980
amber-ff03,n-,ARG,CB,0.0291710
amber-ff03,n-,ARG,HB2,0.0287280
amber-ff03,n-,ARG,HB3,0.0287280
amber-ff03,n-,ARG,CG,-0.0162080
amber-ff03,n-,ARG,HG2,0.0020440
amber-ff03,n-,ARG,HG3,0.0020440
amber-ff03,n-,ARG,CD,0.1765680
amber-ff03,n-,ARG,HD2,0.0484770
amber-ff03,n-,ARG,HD3,0.0484770
amber-ff03,n-,ARG,NE,-0.4505680
amber-ff03,n-,ARG,HE,0.3384670
amber-ff03,n-,ARG,CZ,0.5613600
amber-ff03,n-,ARG,NH1,-0.7064730
amber-ff03,n-,ARG,HH11,0.4059270
amber-ff03,n-,ARG,HH12,0.4059270
amber-ff03,n-,ARG,NH2,-0.7064730
amber-ff03,n-,ARG,HH21,0.4059270
amber-ff03,n-,ARG,HH22,0.4059270
amber-ff03,n-,ARG,C,0.7702840
amber-ff03,n-,ARG,O,-0.6472340
amber-ff03,c+,ARG,N,-0.4953400
amber-ff03,c+,ARG,H,0.3138640
amber-ff03,c+,ARG,CA,-0.1222650
amber-ff03,c+,ARG,HA,0.0930730
amber-ff03,c+,ARG,CB,0.0158200
amber-ff03,c+,ARG,HB2,0.0403760
amber-ff03,c+,ARG,HB3,0.0403760
amber-ff03,c+,ARG,CG,0.0136970
amber-ff03,c+,ARG,HG2,-0.0013660
amber-ff03,c+,ARG,HG3,-0.0013660
amber-ff03,c+,ARG,CD,0.1833240
amber-ff03,c+,ARG,HD2,0.0486910
amber-ff03,c+,ARG,HD3,0.0486910
amber-ff03,c+,ARG,NE,-0.4686820
amber-ff03,c+,ARG,HE,0.3430940
amber-ff03,c+,ARG,CZ,0.5777840
amber-ff03,c+,ARG,NH1,-0.7123180
amber-ff03,c+,ARG,HH11,0.4062160
amber-ff03,c+,ARG,HH12,0.4062160
amber-ff03,c+,ARG,NH2,-0.7123180
amber-ff03,c+,ARG,HH21,0.4062160
amber-ff03,c+,ARG,HH22,0.4062160
amber-ff03,c+,ARG,C,0.6487630
amber-ff03,c+,ARG,O,-0.4632120
amber-ff03,c+,ARG,OXT,-0.4632120
amber-ff03,c+,ARG,HOXT,0.4476610
amber-ff03,m,ARN,N,-0.3008790
amber-ff03,m,ARN,H,0.2336930
amber-ff03,m,ARN,CA,-0.1313810
amber-ff03,m,ARN,HA,0.0532660
amber-ff03,m,ARN,CB,0.0367070
amber-ff03,m,ARN,HB2,0.0280120
amber-ff03,m,ARN,HB3,0.0280120
amber-ff03,m,ARN,CG,0.0124540
amber-ff03,m,ARN,HG2,0.0029640
amber-ff03,m,ARN,HG3,0.0029640
amber-ff03,m,ARN,CD,0.1263290
amber-ff03,m,ARN,HD2,0.0681480
amber-ff03,m,ARN,HD3,0.0681480
amber-ff03,m,ARN,NE,-0.5401740
amber-ff03,m,ARN,HE,0.2509900
amber-ff03,m,ARN,CZ,0.4902590
amber-ff03,m,ARN,NH1,-0.7677340
amber-ff03,m,ARN,HH11,0.3157680
amber-ff03,m,ARN,HH12,0.3157680
amber-ff03,m,ARN,NH2,-0.7610580
amber-ff03,m,ARN,HH21,0.3157680
amber-ff03,m,ARN,C,0.7303080
amber-ff03,m,ARN,O,-0.5783320
amber-ff03,n,ARN,N,-0.6705150
amber-ff03,n,ARN,H1,0.4735050
amber-ff03,n,ARN,H2,0.4735050
amber-ff03,n,ARN,H3,0.4735050
amber-ff03,n,ARN,CA,0.0939030
amber-ff03,n,ARN,HA,0.0249980
amber-ff03,n,ARN,CB,0.0367070
amber-ff03,n,ARN,HB2,0.0280120
amber-ff03,n,ARN,HB3,0.0280120
amber-ff03,n,ARN,CG,0.0124540
amber-ff03,n,ARN,HG2,0.0029640
amber-ff03,n,ARN,HG3,0.0029640
amber-ff03,n,ARN,CD,0.1263290
amber-ff03,n,ARN,HD2,0.0681480
amber-ff03,n,ARN,HD3,0.0681480
amber-ff03,n,ARN,NE,-0.5401740
amber-ff03,n,ARN,HE,0.2509900
amber-ff03,n,ARN,CZ,0.4902590
amber-ff03,n,ARN,NH1,-0.7530100
amber-ff03,n,ARN,HH11,0.3157680
amber-ff03,n,ARN,HH12,0.3157680
amber-ff03,n,ARN,NH2,-0.7610580
amber-ff03,n,ARN,HH21,0.3157680
amber-ff03,n,ARN,C,0.7702840
amber-ff03,n,ARN,O,-0.6472340
amber-ff03,c,ARN,N,-0.4953400
amber-ff03,c,ARN,H,0.3138640
amber-ff03,c,ARN,CA,-0.1222650
amber-ff03,c,ARN,HA,0.0930730
amber-ff03,c,ARN,CB,0.0367070
amber-ff03,c,ARN,HB2,0.0280120
amber-ff03,c,ARN,HB3,0.0280120
amber-ff03,c,ARN,CG,0.0124540
amber-ff03,c,ARN,HG2,0.0029640
amber-ff03,c,ARN,HG3,0.0029640
amber-ff03,c,ARN,CD,0.1263290
amber-ff03,c,ARN,HD2,0.0681480
amber-ff03,c,ARN,HD3,0.0681480
amber-ff03,c,ARN,NE,-0.5401740
amber-ff03,c,ARN,HE,0.2509900
amber-ff03,c,ARN,CZ,0.4902590
amber-ff03,c,ARN,NH1,-0.7203900
amber-ff03,c,ARN,HH11,0.3157680
amber-ff03,c,ARN,HH12,0.3157680
amber-ff03,c,ARN,NH2,-0.7610580
amber-ff03,c,ARN,HH21,0.3157680
amber-ff03,c,ARN,C,0.6487630
amber-ff03,c,ARN,O,-0.7393820
amber-ff03,c,ARN,OXT,-0.7393820
amber-ff03,n-,ARN,N,-1.1970100
amber-ff03,n-,ARN,H1,0.4735050
amber-ff03,n-,ARN,H2,0.4735050
amber-ff03,n-,ARN,CA,0.0939030
amber-ff03,n-,ARN,HA,0.0249980
amber-ff03,n-,ARN,CB,0.0367070
amber-ff03,n-,ARN,HB2,0.0280120
amber-ff03,n-,ARN,HB3,0.0280120
amber-ff03,n-,ARN,CG,0.0124540
amber-ff03,n-,ARN,HG2,0.0029640
amber-ff03,n-,ARN,HG3,0.0029640
amber-ff03,n-,ARN,CD,0.1263290
amber-ff03,n-,ARN,HD2,0.0681480
amber-ff03,n-,ARN,HD3,0.0681480
amber-ff03,n-,ARN,NE,-0.5401740
amber-ff03,n-,ARN,HE,0.2509900
amber-ff03,n-,ARN,CZ,0.4902590
amber-ff03,n-,ARN,NH1,-0.7530100
amber-ff03,n-,ARN,HH11,0.3157680
amber-ff03,n-,ARN,HH12,0.3157680
amber-ff03,n-,ARN,NH2,-0.7610580
amber-ff03,n-,ARN,HH21,0.3157680
amber-ff03,n-,ARN,C,0.7702840
amber-ff03,n-,ARN,O,-0.6472340
amber-ff03,c+,ARN,N,-0.4953400
amber-ff03,c+,ARN,H,0.3138640
amber-ff03,c+,ARN,CA,-0.1222650
amber-ff03,c+,ARN,HA,0.0930730
amber-ff03,c+,ARN,CB,0.0367070
amber-ff03,c+,ARN,HB2,0.0280120
amber-ff03,c+,ARN,HB3,0.0280120
amber-ff03,c+,ARN,CG,0.0124540
amber-ff03,c+,ARN,HG2,0.0029640
amber-ff03,c+,ARN,HG3,0.0029640
amber-ff03,c+,ARN,CD,0.1263290
amber-ff03,c+,ARN,HD2,0.0681480
amber-ff03,c+,ARN,HD3,0.0681480
amber-ff03,c+,ARN,NE,-0.5401740
amber-ff03,c+,ARN,HE,0.2509900
amber-ff03,c+,ARN,CZ,0.4902590
amber-ff03,c+,ARN,NH1,-0.7203900
amber-ff03,c+,ARN,HH11,0.3157680
amber-ff03,c+,ARN,HH12,0.3157680
amber-ff03,c+,ARN,NH2,-0.7610580
amber-ff03,c+,ARN,HH21,0.3157680
amber-ff03,c+,ARN,C,0.6487630
amber-ff03,c+,ARN,O,-0.4632125
amber-ff03,c+,ARN,OXT,-0.4632125
amber-ff03,c+,ARN,HOXT,0.4476610
amber-ff03,m,ASN,N,-0.4301060
amber-ff03,m,ASN,H,0.2545430
amber-ff03,m,ASN,CA,0.0446090
amber-ff03,m,ASN,HA,0.0596010
amber-ff03,m,ASN,CB,-0.0936500
amber-ff03,m,ASN,HB2,0.0433210
amber-ff03,m,ASN,HB3,0.0433210
amber-ff03,m,ASN,CG,0.5835190
amber-ff03,m,ASN,OD1,-0.5268130
amber-ff03,m,ASN,ND2,-0.7817350
amber-ff03,m,ASN,HD21,0.3550790
amber-ff03,m,ASN,HD22,0.3550790
amber-ff03,m,ASN,C,0.6171410
amber-ff03,m,ASN,O,-0.5239090
amber-ff03,n,ASN,N,-0.6691060
amber-ff03,n,ASN,H1,0.4730350
amber-ff03,n,ASN,H2,0.4730350
amber-ff03,n,ASN,H3,0.4730350
amber-ff03,n,ASN,CA,0.2566840
amber-ff03,n,ASN,HA,0.0133060
amber-ff03,n,ASN,CB,-0.0621060
amber-ff03,n,ASN,HB2,0.0382890
amber-ff03,n,ASN,HB3,0.0382890
amber-ff03,n,ASN,CG,0.5549320
amber-ff03,n,ASN,OD1,-0.5687970
amber-ff03,n,ASN,ND2,-0.7845470
amber-ff03,n,ASN,HD21,0.3723440
amber-ff03,n,ASN,HD22,0.3723440
amber-ff03,n,ASN,C,0.6025540
amber-ff03,n,ASN,O,-0.5832930
amber-ff03,c,ASN,N,-0.6265300
amber-ff03,c,ASN,H,0.3432420
amber-ff03,c,ASN,CA,0.0144050
amber-ff03,c,ASN,HA,0.0857960
amber-ff03,c,ASN,CB,-0.0294680
amber-ff03,c,ASN,HB2,0.0457380
amber-ff03,c,ASN,HB3,0.0457380
amber-ff03,c,ASN,CG,0.5515120
amber-ff03,c,ASN,OD1,-0.5674400
amber-ff03,c,ASN,ND2,-0.7662410
amber-ff03,c,ASN,HD21,0.3666240
amber-ff03,c,ASN,HD22,0.3666240
amber-ff03,c,ASN,C,0.6073810
amber-ff03,c,ASN,O,-0.7186910
amber-ff03,c,ASN,OXT,-0.7186910
amber-ff03,n-,ASN,N,-1.1960710
amber-ff03,n-,ASN,H1,0.4730350
amber-ff03,n-,ASN,H2,0.4730350
amber-ff03,n-,ASN,CA,0.2566840
amber-ff03,n-,ASN,HA,0.0133060
amber-ff03,n-,ASN,CB,-0.0621060
amber-ff03,n-,ASN,HB2,0.0382890
amber-ff03,n-,ASN,HB3,0.0382890
amber-ff03,n-,ASN,CG,0.5549320
amber-ff03,n-,ASN,OD1,-0.5687970
amber-ff03,n-,ASN,ND2,-0.7845470
amber-ff03,n-,ASN,HD21,0.3723440
amber-ff03,n-,ASN,HD22,0.3723440
amber-ff03,n-,ASN,C,0.6025540
amber-ff03,n-,ASN,O,-0.5832930
amber-ff03,c+,ASN,N,-0.6265300
amber-ff03,c+,ASN,H,0.3432420
amber-ff03,c+,ASN,CA,0.0144050
amber-ff03,c+,ASN,HA,0.0857960
amber-ff03,c+,ASN,CB,-0.0294680
amber-ff03,c+,ASN,HB2,0.0457380
amber-ff03,c+,ASN,HB3,0.0457380
amber-ff03,c+,ASN,CG,0.5515120
amber-ff03,c+,ASN,OD1,-0.5674400
amber-ff03,c+,ASN,ND2,-0.7662410
amber-ff03,c+,ASN,HD21,0.3666240
amber-ff03,c+,ASN,HD22,0.3666240
amber-ff03,c+,ASN,C,0.6073810
amber-ff03,c+,ASN,O,-0.4425215
amber-ff03,c+,ASN,OXT,-0.4425215
amber-ff03,c+,ASN,HOXT,0.4476610
amber-ff03,m,ASP,N,-0.5582010
amber-ff03,m,ASP,H,0.3196760
amber-ff03,m,ASP,CA,0.0072250
amber-ff03,m,ASP,HA,0.0823750
amber-ff03,m,ASP,CB,-0.0475550
amber-ff03,m,ASP,HB2,-0.0148360
amber-ff03,m,ASP,HB3,-0.0148360
amber-ff03,m,ASP,CG,0.7451680
amber-ff03,m,ASP,OD1,-0.7303850
amber-ff03,m,ASP,OD2,-0.7303850
amber-ff03,m,ASP,C,0.4431990
amber-ff03,m,ASP,O,-0.5014450
amber-ff03,n,ASP,N,-0.5888070
amber-ff03,n,ASP,H1,0.4462690
amber-ff03,n,ASP,H2,0.4462690
amber-ff03,n,ASP,H3,0.4462690
amber-ff03,n,ASP,CA,0.0150240
amber-ff03,n,ASP,HA,0.0907980
amber-ff03,n,ASP,CB,-0.0717920
amber-ff03,n,ASP,HB2,0.0028020
amber-ff03,n,ASP,HB3,0.0028020
amber-ff03,n,ASP,CG,0.7704320
amber-ff03,n,ASP,OD1,-0.7879660
amber-ff03,n,ASP,OD2,-0.7879660
amber-ff03,n,ASP,C,0.6020720
amber-ff03,n,ASP,O,-0.5862060
amber-ff03,c,ASP,N,-0.6494620
amber-ff03,c,ASP,H,0.4268530
amber-ff03,c,ASP,CA,-0.3062860
amber-ff03,c,ASP,HA,0.1831810
amber-ff03,c,ASP,CB,-0.0789860
amber-ff03,c,ASP,HB2,0.0186480
amber-ff03,c,ASP,HB3,0.0186480
amber-ff03,c,ASP,CG,0.8448300
amber-ff03,c,ASP,OD1,-0.8137140
amber-ff03,c,ASP,OD2,-0.8137140
amber-ff03,c,ASP,C,0.7323500
amber-ff03,c,ASP,O,-0.7811750
amber-ff03,c,ASP,OXT,-0.7811750
amber-ff03,n-,ASP,N,-1.1425380
amber-ff03,n-,ASP,H1,0.4462690
amber-ff03,n-,ASP,H2,0.4462690
amber-ff03,n-,ASP,CA,0.0150240
amber-ff03,n-,ASP,HA,0.0907980
amber-ff03,n-,ASP,CB,-0.0717920
amber-ff03,n-,ASP,HB2,0.0028020
amber-ff03,n-,ASP,HB3,0.0028020
amber-ff03,n-,ASP,CG,0.7704320
amber-ff03,n-,ASP,OD1,-0.7879660
amber-ff03,n-,ASP,OD2,-0.7879660
amber-ff03,n-,ASP,C,0.6020720
amber-ff03,n-,ASP,O,-0.5862060
amber-ff03,c+,ASP,N,-0.6494620
amber-ff03,c+,ASP,H,0.4268530
amber-ff03,c+,ASP,CA,-0.3062860
amber-ff03,c+,ASP,HA,0.1831810
amber-ff03,c+,ASP,CB,-0.0789860
amber-ff03,c+,ASP,HB2,0.0186480
amber-ff03,c+,ASP,HB3,0.0186480
amber-ff03,c+,ASP,CG,0.8448300
amber-ff03,c+,ASP,OD1,-0.8137140
amber-ff03,c+,ASP,OD2,-0.8137140
amber-ff03,c+,ASP,C,0.7323500
amber-ff03,c+,ASP,O,-0.5050055
amber-ff03,c+,ASP,OXT,-0.5050055
amber-ff03,c+,ASP,HOXT,0.4476610
amber-ff03,m,ASH,N,-0.3920690
amber-ff03,m,ASH,H,0.2824130
amber-ff03,m,ASH,CA,-0.0353170
amber-ff03,m,ASH,HA,0.0942920
amber-ff03,m,ASH,CB,-0.1214050
amber-ff03,m,ASH,HB2,0.0690320
amber-ff03,m,ASH,HB3,0.0690320
amber-ff03,m,ASH,CG,0.6786400
amber-ff03,m,ASH,OD1,-0.5509400
amber-ff03,m,ASH,OD2,-0.5871630
amber-ff03,m,ASH,HD2,0.4380350
amber-ff03,m,ASH,C,0.6204950
amber-ff03,m,ASH,O,-0.5650450
amber-ff03,n,ASH,N,-0.5888070
amber-ff03,n,ASH,H1,0.4462690
amber-ff03,n,ASH,H2,0.4462690
amber-ff03,n,ASH,H3,0.4462690
amber-ff03,n,ASH,CA,0.0150240
amber-ff03,n,ASH,HA,0.0907980
amber-ff03,n,ASH,CB,-0.1903581
amber-ff03,n,ASH,HB2,0.1374520
amber-ff03,n,ASH,HB3,0.1374520
amber-ff03,n,ASH,CG,0.6636213
amber-ff03,n,ASH,OD1,-0.4998671
amber-ff03,n,ASH,OD2,-0.5580231
amber-ff03,n,ASH,HD2,0.4380350
amber-ff03,n,ASH,C,0.6020720
amber-ff03,n,ASH,O,-0.5862060
amber-ff03,c,ASH,N,-0.6494620
amber-ff03,c,ASH,H,0.4268530
amber-ff03,c,ASH,CA,-0.3062860
amber-ff03,c,ASH,HA,0.1831810
amber-ff03,c,ASH,CB,-0.1975526
amber-ff03,c,ASH,HB2,0.1532985
amber-ff03,c,ASH,HB3,0.1532985
amber-ff03,c,ASH,CG,0.7380189
amber-ff03,c,ASH,OD1,-0.5256141
amber-ff03,c,ASH,OD2,-0.5837703
amber-ff03,c,ASH,HD2,0.4380350
amber-ff03,c,ASH,C,0.7323500
amber-ff03,c,ASH,O,-0.7811750
amber-ff03,c,ASH,OXT,-0.7811750
amber-ff03,n-,ASH,N,-1.1425380
amber-ff03,n-,ASH,H1,0.4462690
amber-ff03,n-,ASH,H2,0.4462690
amber-ff03,n-,ASH,CA,0.0150240
amber-ff03,n-,ASH,HA,0.0907980
amber-ff03,n-,ASH,CB,-0.1903581
amber-ff03,n-,ASH,HB2,0.1374520
amber-ff03,n-,ASH,HB3,0.1374520
amber-ff03,n-,ASH,CG,0.6636213
amber-ff03,n-,ASH,OD1,-0.4998671
amber-ff03,n-,ASH,OD2,-0.5580231
amber-ff03,n-,ASH,HD2,0.4380350
amber-ff03,n-,ASH,C,0.6020720
amber-ff03,n-,ASH,O,-0.5862060
amber-ff03,c+,ASH,N,-0.6494620
amber-ff03,c+,ASH,H,0.4268530
amber-ff03,c+,ASH,CA,-0.3062860
amber-ff03,c+,ASH,HA,0.1831810
amber-ff03,c+,ASH,CB,-0.1975526
amber-ff03,c+,ASH,HB2,0.1532985
amber-ff03,c+,ASH,HB3,0.1532985
amber-ff03,c+,ASH,CG,0.7380189
amber-ff03,c+,ASH,OD1,-0.5256141
amber-ff03,c+,ASH,OD2,-0.5837703
amber-ff03,c+,ASH,HD2,0.4380350
amber-ff03,c+,ASH,C,0.7323500
amber-ff03,c+,ASH,O,-0.5050055
amber-ff03,c+,ASH,OXT,-0.5050055
amber-ff03,c+,ASH,HOXT,0.4476610
amber-ff03,m,CYS,N,-0.3961650
amber-ff03,m,CYS,H,0.2951870
amber-ff03,m,CYS,CA,-0.0735010
amber-ff03,m,CYS,HA,0.1405100
amber-ff03,m,CYS,CB,-0.2213710
amber-ff03,m,CYS,HB2,0.1465370
amber-ff03,m,CYS,HB3,0.1465370
amber-ff03,m,CYS,SG,-0.2851820
amber-ff03,m,CYS,HG,0.1892740
amber-ff03,m,CYS,C,0.6430350
amber-ff03,m,CYS,O,-0.5848610
amber-ff03,n,CYS,N,-0.6037790
amber-ff03,n,CYS,H1,0.4512600
amber-ff03,n,CYS,H2,0.4512600
amber-ff03,n,CYS,H3,0.4512600
amber-ff03,n,CYS,CA,0.0721500
amber-ff03,n,CYS,HA,0.0832030
amber-ff03,n,CYS,CB,-0.1551130
amber-ff03,n,CYS,HB2,0.1137420
amber-ff03,n,CYS,HB3,0.1137420
amber-ff03,n,CYS,SG,-0.2933800
amber-ff03,n,CYS,HG,0.1907050
amber-ff03,n,CYS,C,0.7478570
amber-ff03,n,CYS,O,-0.6229080
amber-ff03,c,CYS,N,-0.5550370
amber-ff03,c,CYS,H,0.3454830
amber-ff03,c,CYS,CA,-0.1109290
amber-ff03,c,CYS,HA,0.1472060
amber-ff03,c,CYS,CB,-0.1624280
amber-ff03,c,CYS,HB2,0.1319990
amber-ff03,c,CYS,HB3,0.1319990
amber-ff03,c,CYS,SG,-0.2907110
amber-ff03,c,CYS,HG,0.1924190
amber-ff03,c,CYS,C,0.6719420
amber-ff03,c,CYS,O,-0.7509710
amber-ff03,c,CYS,OXT,-0.7509710
amber-ff03,n-,CYS,N,-1.1525190
amber-ff03,n-,CYS,H1,0.4512600
amber-ff03,n-,CYS,H2,0.4512600
amber-ff03,n-,CYS,CA,0.0721500
amber-ff03,n-,CYS,HA,0.0832030
amber-ff03,n-,CYS,CB,-0.1551130
amber-ff03,n-,CYS,HB2,0.1137420
amber-ff03,n-,CYS,HB3,0.1137420
amber-ff03,n-,CYS,SG,-0.2933800
amber-ff03,n-,CYS,HG,0.1907050
amber-ff03,n-,CYS,C,0.7478570
amber-ff03,n-,CYS,O,-0.6229080
amber-ff03,c+,CYS,N,-0.5550370
amber-ff03,c+,CYS,H,0.3454830
amber-ff03,c+,CYS,CA,-0.1109290
amber-ff03,c+,CYS,HA,0.1472060
amber-ff03,c+,CYS,CB,-0.1624280
amber-ff03,c+,CYS,HB2,0.1319990
amber-ff03,c+,CYS,HB3,0.1319990
amber-ff03,c+,CYS,SG,-0.2907110
amber-ff03,c+,CYS,HG,0.1924190
amber-ff03,c+,CYS,C,0.6719420
amber-ff03,c+,CYS,O,-0.4748015
amber-ff03,c+,CYS,OXT,-0.4748015
amber-ff03,c+,CYS,HOXT,0.4476610
amber-ff03,m,CYM,N,-0.4157000
amber-ff03,m,CYM,H,0.2719000
amber-ff03,m,CYM,CA,-0.0351000
amber-ff03,m,CYM,HA,0.0508000
amber-ff03,m,CYM,CB,-0.2413000
amber-ff03,m,CYM,HB2,0.1122000
amber-ff03,m,CYM,HB3,0.1122000
amber-ff03,m,CYM,SG,-0.8844000
amber-ff03,m,CYM,C,0.5973000
amber-ff03,m,CYM,O,-0.5679000
amber-ff03,n,CYM,N,-0.6103550
amber-ff03,n,CYM,H1,0.4534520
amber-ff03,n,CYM,H2,0.4534520
amber-ff03,n,CYM,H3,0.4534520
amber-ff03,n,CYM,CA,0.0721500
amber-ff03,n,CYM,HA,0.0832030
amber-ff03,n,CYM,CB,-0.2413000
amber-ff03,n,CYM,HB2,0.1122000
amber-ff03,n,CYM,HB3,0.1122000
amber-ff03,n,CYM,SG,-1.0134030
amber-ff03,n,CYM,C,0.7478570
amber-ff03,n,CYM,O,-0.6229080
amber-ff03,c,CYM,N,-0.5550370
amber-ff03,c,CYM,H,0.3454830
amber-ff03,c,CYM,CA,-0.1109290
amber-ff03,c,CYM,HA,0.1472060
amber-ff03,c,CYM,CB,-0.2413000
amber-ff03,c,CYM,HB2,0.1122000
amber-ff03,c,CYM,HB3,0.1122000
amber-ff03,c,CYM,SG,-0.9798230
amber-ff03,c,CYM,C,0.6719420
amber-ff03,c,CYM,O,-0.7509710
amber-ff03,c,CYM,OXT,-0.7509710
amber-ff03,n-,CYM,N,-1.1569030
amber-ff03,n-,CYM,H1,0.4534520
amber-ff03,n-,CYM,H2,0.4534520
amber-ff03,n-,CYM,CA,0.0721500
amber-ff03,n-,CYM,HA,0.0832030
amber-ff03,n-,CYM,CB,-0.2413000
amber-ff03,n-,CYM,HB2,0.1122000
amber-ff03,n-,CYM,HB3,0.1122000
amber-ff03,n-,CYM,SG,-1.0134030
amber-ff03,n-,CYM,C,0.7478570
amber-ff03,n-,CYM,O,-0.6229080
amber-ff03,c+,CYM,N,-0.5550370
amber-ff03,c+,CYM,H,0.3454830
amber-ff03,c+,CYM,CA,-0.1109290
amber-ff03,c+,CYM,HA,0.1472060
amber-ff03,c+,CYM,CB,-0.2413000
amber-ff03,c+,CYM,HB2,0.1122000
amber-ff03,c+,CYM,HB3,0.1122000
amber-ff03,c+,CYM,SG,-0.9798230
amber-ff03,c+,CYM,C,0.6719420
amber-ff03,c+,CYM,O,-0.4748015
amber-ff03,c+,CYM,OXT,-0.4748015
amber-ff03,c+,CYM,HOXT,0.4476610
amber-ff03,m,CYX,N,-0.4359210
amber-ff03,m,CYX,H,0.2900770
amber-ff03,m,CYX,CA,-0.0305470
amber-ff03,m,CYX,HA,0.1321460
amber-ff03,m,CYX,CB,-0.0330060
amber-ff03,m,CYX,HB2,0.0789510
amber-ff03,m,CYX,HB3,0.0789510
amber-ff03,m,CYX,SG,-0.1322720
amber-ff03,m,CYX,C,0.6247880
amber-ff03,m,CYX,O,-0.5731670
amber-ff03,n,CYX,N,-0.6103550
amber-ff03,n,CYX,H1,0.4534520
amber-ff03,n,CYX,H2,0.4534520
amber-ff03,n,CYX,H3,0.4534520
amber-ff03,n,CYX,CA,0.0721500
amber-ff03,n,CYX,HA,0.0832030
amber-ff03,n,CYX,CB,-0.0330060
amber-ff03,n,CYX,HB2,0.0789510
amber-ff03,n,CYX,HB3,0.0789510
amber-ff03,n,CYX,SG,-0.1551990
amber-ff03,n,CYX,C,0.7478570
amber-ff03,n,CYX,O,-0.6229080
amber-ff03,c,CYX,N,-0.5550370
amber-ff03,c,CYX,H,0.3454830
amber-ff03,c,CYX,CA,-0.1109290
amber-ff03,c,CYX,HA,0.1472060
amber-ff03,c,CYX,CB,-0.0330060
amber-ff03,c,CYX,HB2,0.0789510
amber-ff03,c,CYX,HB3,0.0789510
amber-ff03,c,CYX,SG,-0.1216190
amber-ff03,c,CYX,C,0.6719420
amber-ff03,c,CYX,O,-0.7509710
amber-ff03,c,CYX,OXT,-0.7509710
amber-ff03,n-,CYX,N,-1.1569030
amber-ff03,n-,CYX,H1,0.4534520
amber-ff03,n-,CYX,H2,0.4534520
amber-ff03,n-,CYX,CA,0.0721500
amber-ff03,n-,CYX,HA,0.0832030
amber-ff03,n-,CYX,CB,-0.0330060
amber-ff03,n-,CYX,HB2,0.0789510
amber-ff03,n-,CYX,HB3,0.0789510
amber-ff03,n-,CYX,SG,-0.1551990
amber-ff03,n-,CYX,C,0.7478570
amber-ff03,n-,CYX,O,-0.6229080
amber-ff03,c+,CYX,N,-0.5550370
amber-ff03,c+,CYX,H,0.3454830
amber-ff03,c+,CYX,CA,-0.1109290
amber-ff03,c+,CYX,HA,0.1472060
amber-ff03,c+,CYX,CB,-0.0330060
amber-ff03,c+,CYX,HB2,0.0789510
amber-ff03,c+,CYX,HB3,0.0789510
amber-ff03,c+,CYX,SG,-0.1216190
amber-ff03,c+,CYX,C,0.6719420
amber-ff03,c+,CYX,O,-0.4748015
amber-ff03,c+,CYX,OXT,-0.4748015
amber-ff03,c+,CYX,HOXT,0.4476610
amber-ff03,m,GLN,N,-0.3873530
amber-ff03,m,GLN,H,0.3006050
amber-ff03,m,GLN,CA,0.0374700
amber-ff03,m,GLN,HA,0.1522550
amber-ff03,m,GLN,CB,-0.0321120
amber-ff03,m,GLN,HB2,0.0309950
amber-ff03,m,GLN,HB3,0.0309950
amber-ff03,m,GLN,CG,-0.0202640
amber-ff03,m,GLN,HG2,0.0307910
amber-ff03,m,GLN,HG3,0.0307910
amber-ff03,m,GLN,CD,0.6678120
amber-ff03,m,GLN,OE1,-0.6284830
amber-ff03,m,GLN,NE2,-0.8833930
amber-ff03,m,GLN,HE21,0.4083120
amber-ff03,m,GLN,HE22,0.4083120
amber-ff03,m,GLN,C,0.4185770
amber-ff03,m,GLN,O,-0.5653100
amber-ff03,n,GLN,N,-0.6037790
amber-ff03,n,GLN,H1,0.4512600
amber-ff03,n,GLN,H2,0.4512600
amber-ff03,n,GLN,H3,0.4512600
amber-ff03,n,GLN,CA,0.2011270
amber-ff03,n,GLN,HA,0.0289300
amber-ff03,n,GLN,CB,-0.0132770
amber-ff03,n,GLN,HB2,0.0018270
amber-ff03,n,GLN,HB3,0.0018270
amber-ff03,n,GLN,CG,-0.0307070
amber-ff03,n,GLN,HG2,0.0246650
amber-ff03,n,GLN,HG3,0.0246650
amber-ff03,n,GLN,CD,0.6695680
amber-ff03,n,GLN,OE1,-0.5858020
amber-ff03,n,GLN,NE2,-0.8896520
amber-ff03,n,GLN,HE21,0.3973060
amber-ff03,n,GLN,HE22,0.3973060
amber-ff03,n,GLN,C,0.6066340
amber-ff03,n,GLN,O,-0.5844150
amber-ff03,c,GLN,N,-0.5151350
amber-ff03,c,GLN,H,0.3242990
amber-ff03,c,GLN,CA,-0.2356300
amber-ff03,c,GLN,HA,0.1646280
amber-ff03,c,GLN,CB,0.0048130
amber-ff03,c,GLN,HB2,0.0307880
amber-ff03,c,GLN,HB3,0.0307880
amber-ff03,c,GLN,CG,-0.0248480
amber-ff03,c,GLN,HG2,0.0348400
amber-ff03,c,GLN,HG3,0.0348400
amber-ff03,c,GLN,CD,0.6623210
amber-ff03,c,GLN,OE1,-0.5887990
amber-ff03,c,GLN,NE2,-0.8835700
amber-ff03,c,GLN,HE21,0.3953340
amber-ff03,c,GLN,HE22,0.3953340
amber-ff03,c,GLN,C,0.6004480
amber-ff03,c,GLN,O,-0.7152240
amber-ff03,c,GLN,OXT,-0.7152240
amber-ff03,n-,GLN,N,-1.1525190
amber-ff03,n-,GLN,H1,0.4512600
amber-ff03,n-,GLN,H2,0.4512600
amber-ff03,n-,GLN,CA,0.2011270
amber-ff03,n-,GLN,HA,0.0289300
amber-ff03,n-,GLN,CB,-0.0132770
amber-ff03,n-,GLN,HB2,0.0018270
amber-ff03,n-,GLN,HB3,0.0018270
amber-ff03,n-,GLN,CG,-0.0307070
amber-ff03,n-,GLN,HG2,0.0246650
amber-ff03,n-,GLN,HG3,0.0246650
amber-ff03,n-,GLN,CD,0.6695680
amber-ff03,n-,GLN,OE1,-0.5858020
amber-ff03,n-,GLN,NE2,-0.8896520
amber-ff03,n-,GLN,HE21,0.3973060
amber-ff03,n-,GLN,HE22,0.3973060
amber-ff03,n-,GLN,C,0.6066340
amber-ff03,n-,GLN,O,-0.5844150
amber-ff03,c+,GLN,N,-0.5151350
amber-ff03,c+,GLN,H,0.3242990
amber-ff03,c+,GLN,CA,-0.2356300
amber-ff03,c+,GLN,HA,0.1646280
amber-ff03,c+,GLN,CB,0.0048130
amber-ff03,c+,GLN,HB2,0.0307880
amber-ff03,c+,GLN,HB3,0.0307880
amber-ff03,c+,GLN,CG,-0.0248480
amber-ff03,c+,GLN,HG2,0.0348400
amber-ff03,c+,GLN,HG3,0.0348400
amber-ff03,c+,GLN,CD,0.6623210
amber-ff03,c+,GLN,OE1,-0.5887990
amber-ff03,c+,GLN,NE2,-0.8835700
amber-ff03,c+,GLN,HE21,0.3953340
amber-ff03,c+,GLN,HE22,0.3953340
amber-ff03,c+,GLN,C,0.6004480
amber-ff03,c+,GLN,O,-0.4390545
amber-ff03,c+,GLN,OXT,-0.4390545
amber-ff03,c+,GLN,HOXT,0.4476610
amber-ff03,m,GLU,N,-0.4233920
amber-ff03,m,GLU,H,0.3068110
amber-ff03,m,GLU,CA,0.0316330
amber-ff03,m,GLU,HA,0.0651000
amber-ff03,m,GLU,CB,0.0747720
amber-ff03,m,GLU,HB2,-0.0035350
amber-ff03,m,GLU,HB3,-0.0035350
amber-ff03,m,GLU,CG,-0.0339090
amber-ff03,m,GLU,HG2,-0.0041350
amber-ff03,m,GLU,HG3,-0.0041350
amber-ff03,m,GLU,CD,0.7651880
amber-ff03,m,GLU,OE1,-0.8240350
amber-ff03,m,GLU,OE2,-0.8240350
amber-ff03,m,GLU,C,0.4697350
amber-ff03,m,GLU,O,-0.5925280
amber-ff03,n,GLU,N,-0.4653280
amber-ff03,n,GLU,H1,0.4051090
amber-ff03,n,GLU,H2,0.4051090
amber-ff03,n,GLU,H3,0.4051090
amber-ff03,n,GLU,CA,0.1271990
amber-ff03,n,GLU,HA,0.0230380
amber-ff03,n,GLU,CB,0.0882820
amber-ff03,n,GLU,HB2,-0.0342190
amber-ff03,n,GLU,HB3,-0.0342190
amber-ff03,n,GLU,CG,-0.0096730
amber-ff03,n,GLU,HG2,-0.0215240
amber-ff03,n,GLU,HG3,-0.0215240
amber-ff03,n,GLU,CD,0.7400150
amber-ff03,n,GLU,OE1,-0.7805450
amber-ff03,n,GLU,OE2,-0.7805450
amber-ff03,n,GLU,C,0.5525510
amber-ff03,n,GLU,O,-0.5988350
amber-ff03,c,GLU,N,-0.7487780
amber-ff03,c,GLU,H,0.3961250
amber-ff03,c,GLU,CA,-0.1331590
amber-ff03,c,GLU,HA,0.1057300
amber-ff03,c,GLU,CB,0.1857490
amber-ff03,c,GLU,HB2,-0.0459570
amber-ff03,c,GLU,HB3,-0.0459570
amber-ff03,c,GLU,CG,-0.0331250
amber-ff03,c,GLU,HG2,-0.0118320
amber-ff03,c,GLU,HG3,-0.0118320
amber-ff03,c,GLU,CD,0.7579640
amber-ff03,c,GLU,OE1,-0.7924630
amber-ff03,c,GLU,OE2,-0.7924630
amber-ff03,c,GLU,C,0.7311860
amber-ff03,c,GLU,O,-0.7805930
amber-ff03,c,GLU,OXT,-0.7805930
amber-ff03,n-,GLU,N,-1.0602190
amber-ff03,n-,GLU,H1,0.4051090
amber-ff03,n-,GLU,H2,0.4051090
amber-ff03,n-,GLU,CA,0.1271990
amber-ff03,n-,GLU,HA,0.0230380
amber-ff03,n-,GLU,CB,0.0882820
amber-ff03,n-,GLU,HB2,-0.0342190
amber-ff03,n-,GLU,HB3,-0.0342190
amber-ff03,n-,GLU,CG,-0.0096730
amber-ff03,n-,GLU,HG2,-0.0215240
amber-ff03,n-,GLU,HG3,-0.0215240
amber-ff03,n-,GLU,CD,0.7400150
amber-ff03,n-,GLU,OE1,-0.7805450
amber-ff03,n-,GLU,OE2,-0.7805450
amber-ff03,n-,GLU,C,0.5525510
amber-ff03,n-,GLU,O,-0.5988350
amber-ff03,c+,GLU,N,-0.7487780
amber-ff03,c+,GLU,H,0.3961250
amber-ff03,c+,GLU,CA,-0.1331590
amber-ff03,c+,GLU,HA,0.1057300
amber-ff03,c+,GLU,CB,0.1857490
amber-ff03,c+,GLU,HB2,-0.0459570
amber-ff03,c+,GLU,HB3,-0.0459570
amber-ff03,c+,GLU,CG,-0.0331250
amber-ff03,c+,GLU,HG2,-0.0118320
amber-ff03,c+,GLU,HG3,-0.0118320
amber-ff03,c+,GLU,CD,0.7579640
amber-ff03,c+,GLU,OE1,-0.7924630
amber-ff03,c+,GLU,OE2,-0.7924630
amber-ff03,c+,GLU,C,0.7311860
amber-ff03,c+,GLU,O,-0.5044235
amber-ff03,c+,GLU,OXT,-0.5044235
amber-ff03,c+,GLU,HOXT,0.4476610
amber-ff03,m,GLH,N,-0.3845360
amber-ff03,m,GLH,H,0.2639630
amber-ff03,m,GLH,CA,-0.0608980
amber-ff03,m,GLH,HA,0.1096200
amber-ff03,m,GLH,CB,-0.0187530
amber-ff03,m,GLH,HB2,0.0349660
amber-ff03,m,GLH,HB3,0.0349660
amber-ff03,m,GLH,CG,-0.0383640
amber-ff03,m,GLH,HG2,0.0484440
amber-ff03,m,GLH,HG3,0.0484440
amber-ff03,m,GLH,CD,0.6389370
amber-ff03,m,GLH,OE1,-0.5590310
amber-ff03,m,GLH,OE2,-0.5887220
amber-ff03,m,GLH,HE2,0.4476610
amber-ff03,m,GLH,C,0.5870560
amber-ff03,m,GLH,O,-0.5637530
amber-ff03,n,GLH,N,-0.4653280
amber-ff03,n,GLH,H1,0.4051090
amber-ff03,n,GLH,H2,0.4051090
amber-ff03,n,GLH,H3,0.4051090
amber-ff03,n,GLH,CA,0.1271990
amber-ff03,n,GLH,HA,0.0230380
amber-ff03,n,GLH,CB,-0.0244468
amber-ff03,n,GLH,HB2,0.0121875
amber-ff03,n,GLH,HB3,0.0121875
amber-ff03,n,GLH,CG,-0.0150428
amber-ff03,n,GLH,HG2,0.0418512
amber-ff03,n,GLH,HG3,0.0418512
amber-ff03,n,GLH,CD,0.5878405
amber-ff03,n,GLH,OE1,-0.4611269
amber-ff03,n,GLH,OE2,-0.4969145
amber-ff03,n,GLH,HE2,0.4476610
amber-ff03,n,GLH,C,0.5525510
amber-ff03,n,GLH,O,-0.5988350
amber-ff03,c,GLH,N,-0.7487780
amber-ff03,c,GLH,H,0.3961250
amber-ff03,c,GLH,CA,-0.1331590
amber-ff03,c,GLH,HA,0.1057300
amber-ff03,c,GLH,CB,0.0730206
amber-ff03,c,GLH,HB2,0.0004494
amber-ff03,c,GLH,HB3,0.0004494
amber-ff03,c,GLH,CG,-0.0384947
amber-ff03,c,GLH,HG2,0.0515430
amber-ff03,c,GLH,HG3,0.0515430
amber-ff03,c,GLH,CD,0.6057901
amber-ff03,c,GLH,OE1,-0.4730461
amber-ff03,c,GLH,OE2,-0.5088335
amber-ff03,c,GLH,HE2,0.4476610
amber-ff03,c,GLH,C,0.7311860
amber-ff03,c,GLH,O,-0.7805930
amber-ff03,c,GLH,OXT,-0.7805930
amber-ff03,n-,GLH,N,-1.0602190
amber-ff03,n-,GLH,H1,0.4051090
amber-ff03,n-,GLH,H2,0.4051090
amber-ff03,n-,GLH,CA,0.1271990
amber-ff03,n-,GLH,HA,0.0230380
amber-ff03,n-,GLH,CB,-0.0244468
amber-ff03,n-,GLH,HB2,0.0121875
amber-ff03,n-,GLH,HB3,0.0121875
amber-ff03,n-,GLH,CG,-0.0150428
amber-ff03,n-,GLH,HG2,0.0418512
amber-ff03,n-,GLH,HG3,0.0418512
amber-ff03,n-,GLH,CD,0.5878405
amber-ff03,n-,GLH,OE1,-0.4611269
amber-ff03,n-,GLH,OE2,-0.4969145
amber-ff03,n-,GLH,HE2,0.4476610
amber-ff03,n-,GLH,C,0.5525510
amber-ff03,n-,GLH,O,-0.5988350
amber-ff03,c+,GLH,N,-0.7487780
amber-ff03,c+,GLH,H,0.3961250
amber-ff03,c+,GLH,CA,-0.1331590
amber-ff03,c+,GLH,HA,0.1057300
amber-ff03,c+,GLH,CB,0.0730206
amber-ff03,c+,GLH,HB2,0.0004494
amber-ff03,c+,GLH,HB3,0.0004494
amber-ff03,c+,GLH,CG,-0.0384947
amber-ff03,c+,GLH,HG2,0.0515430
amber-ff03,c+,GLH,HG3,0.0515430
amber-ff03,c+,GLH,CD,0.6057901
amber-ff03,c+,GLH,OE1,-0.4730461
amber-ff03,c+,GLH,OE2,-0.5088335
amber-ff03,c+,GLH,HE2,0.4476610
amber-ff03,c+,GLH,C,0.7311860
amber-ff03,c+,GLH,O,-0.5044235
amber-ff03,c+,GLH,OXT,-0.5044235
amber-ff03,c+,GLH,HOXT,0.4476610
amber-ff03,m,GLY,N,-0.3742820
amber-ff03,m,GLY,H,0.2539810
amber-ff03,m,GLY,CA,-0.1288440
amber-ff03,m,GLY,HA2,0.0888590
amber-ff03,m,GLY,HA3,0.0888590
amber-ff03,m,GLY,C,0.5805840
amber-ff03,m,GLY,O,-0.5091570
amber-ff03,n,GLY,N,-0.6007660
amber-ff03,n,GLY,H1,0.4502550
amber-ff03,n,GLY,H2,0.4502550
amber-ff03,n,GLY,H3,0.4502550
amber-ff03,n,GLY,CA,0.1268910
amber-ff03,n,GLY,HA2,0.0368490
amber-ff03,n,GLY,HA3,0.0368490
amber-ff03,n,GLY,C,0.6487680
amber-ff03,n,GLY,O,-0.5993570
amber-ff03,c,GLY,N,-0.5233620
amber-ff03,c,GLY,H,0.3496220
amber-ff03,c,GLY,CA,-0.3166590
amber-ff03,c,GLY,HA2,0.1602000
amber-ff03,c,GLY,HA3,0.1602000
amber-ff03,c,GLY,C,0.6617970
amber-ff03,c,GLY,O,-0.7458990
amber-ff03,c,GLY,OXT,-0.7458990
amber-ff03,n-,GLY,N,-1.1505110
amber-ff03,n-,GLY,H1,0.4502550
amber-ff03,n-,GLY,H2,0.4502550
amber-ff03,n-,GLY,CA,0.1268910
amber-ff03,n-,GLY,HA2,0.0368490
amber-ff03,n-,GLY,HA3,0.0368490
amber-ff03,n-,GLY,C,0.6487680
amber-ff03,n-,GLY,O,-0.5993570
amber-ff03,c+,GLY,N,-0.5233620
amber-ff03,c+,GLY,H,0.3496220
amber-ff03,c+,GLY,CA,-0.3166590
amber-ff03,c+,GLY,HA2,0.1602000
amber-ff03,c+,GLY,HA3,0.1602000
amber-ff03,c+,GLY,C,0.6617970
amber-ff03,c+,GLY,O,-0.4697295
amber-ff03,c+,GLY,OXT,-0.4697295
amber-ff03,c+,GLY,HOXT,0.4476610
amber-ff03,m,HID,N,-0.5067990
amber-ff03,m,HID,H,0.3510210
amber-ff03,m,HID,CA,0.1190660
amber-ff03,m,HID,HA,0.1377610
amber-ff03,m,HID,CB,-0.1226380
amber-ff03,m,HID,HB2,0.0863290
amber-ff03,m,HID,HB3,0.0863290
amber-ff03,m,HID,CG,-0.0015470
amber-ff03,m,HID,ND1,-0.2057850
amber-ff03,m,HID,HD1,0.3182730
amber-ff03,m,HID,CD2,0.0437440
amber-ff03,m,HID,HD2,0.1101570
amber-ff03,m,HID,CE1,0.1472730
amber-ff03,m,HID,HE1,0.1221820
amber-ff03,m,HID,NE2,-0.6014820
amber-ff03,m,HID,C,0.5159470
amber-ff03,m,HID,O,-0.5998310
amber-ff03,n,HID,N,-0.7022020
amber-ff03,n,HID,H1,0.4840670
amber-ff03,n,HID,H2,0.4840670
amber-ff03,n,HID,H3,0.4840670
amber-ff03,n,HID,CA,0.2701120
amber-ff03,n,HID,HA,0.0239460
amber-ff03,n,HID,CB,-0.0661990
amber-ff03,n,HID,HB2,0.0454930
amber-ff03,n,HID,HB3,0.0454930
amber-ff03,n,HID,CG,-0.0292950
amber-ff03,n,HID,ND1,-0.2175840
amber-ff03,n,HID,HD1,0.2938400
amber-ff03,n,HID,CD2,0.0711090
amber-ff03,n,HID,HD2,0.0961990
amber-ff03,n,HID,CE1,0.1475320
amber-ff03,n,HID,HE1,0.1100990
amber-ff03,n,HID,NE2,-0.5515850
amber-ff03,n,HID,C,0.5906510
amber-ff03,n,HID,O,-0.5798090
amber-ff03,c,HID,N,-0.6925100
amber-ff03,c,HID,H,0.3577840
amber-ff03,c,HID,CA,0.1134710
amber-ff03,c,HID,HA,0.0704900
amber-ff03,c,HID,CB,-0.0322370
amber-ff03,c,HID,HB2,0.0478580
amber-ff03,c,HID,HB3,0.0478580
amber-ff03,c,HID,CG,-0.0346910
amber-ff03,c,HID,ND1,-0.2187670
amber-ff03,c,HID,HD1,0.2941040
amber-ff03,c,HID,CD2,0.0735050
amber-ff03,c,HID,HD2,0.0951470
amber-ff03,c,HID,CE1,0.1521510
amber-ff03,c,HID,HE1,0.1087260
amber-ff03,c,HID,NE2,-0.5528870
amber-ff03,c,HID,C,0.6223310
amber-ff03,c,HID,O,-0.7261660
amber-ff03,c,HID,OXT,-0.7261660
amber-ff03,n-,HID,N,-1.2181350
amber-ff03,n-,HID,H1,0.4840670
amber-ff03,n-,HID,H2,0.4840670
amber-ff03,n-,HID,CA,0.2701120
amber-ff03,n-,HID,HA,0.0239460
amber-ff03,n-,HID,CB,-0.0661990
amber-ff03,n-,HID,HB2,0.0454930
amber-ff03,n-,HID,HB3,0.0454930
amber-ff03,n-,HID,CG,-0.0292950
amber-ff03,n-,HID,ND1,-0.2175840
amber-ff03,n-,HID,HD1,0.2938400
amber-ff03,n-,HID,CD2,0.0711090
amber-ff03,n-,HID,HD2,0.0961990
amber-ff03,n-,HID,CE1,0.1475320
amber-ff03,n-,HID,HE1,0.1100990
amber-ff03,n-,HID,NE2,-0.5515850
amber-ff03,n-,HID,C,0.5906510
amber-ff03,n-,HID,O,-0.5798090
amber-ff03,c+,HID,N,-0.6925100
amber-ff03,c+,HID,H,0.3577840
amber-ff03,c+,HID,CA,0.1134710
amber-ff03,c+,HID,HA,0.0704900
amber-ff03,c+,HID,CB,-0.0322370
amber-ff03,c+,HID,HB2,0.0478580
amber-ff03,c+,HID,HB3,0.0478580
amber-ff03,c+,HID,CG,-0.0346910
amber-ff03,c+,HID,ND1,-0.2187670
amber-ff03,c+,HID,HD1,0.2941040
amber-ff03,c+,HID,CD2,0.0735050
amber-ff03,c+,HID,HD2,0.0951470
amber-ff03,c+,HID,CE1,0.1521510
amber-ff03,c+,HID,HE1,0.1087260
amber-ff03,c+,HID,NE2,-0.5528870
amber-ff03,c+,HID,C,0.6223310
amber-ff03,c+,HID,O,-0.4499965
amber-ff03,c+,HID,OXT,-0.4499965
amber-ff03,c+,HID,HOXT,0.4476610
amber-ff03,m,HIE,N,-0.5281200
amber-ff03,m,HIE,H,0.2816950
amber-ff03,m,HIE,CA,0.0312490
amber-ff03,m,HIE,HA,0.0851750
amber-ff03,m,HIE,CB,-0.1522670
amber-ff03,m,HIE,HB2,0.0546080
amber-ff03,m,HIE,HB3,0.0546080
amber-ff03,m,HIE,CG,0.2784060
amber-ff03,m,HIE,ND1,-0.4233160
amber-ff03,m,HIE,CD2,-0.2975630
amber-ff03,m,HIE,HD2,0.1604130
amber-ff03,m,HIE,CE1,0.0259600
amber-ff03,m,HIE,HE1,0.1268320
amber-ff03,m,HIE,NE2,-0.0979840
amber-ff03,m,HIE,HE2,0.2668650
amber-ff03,m,HIE,C,0.6624050
amber-ff03,m,HIE,O,-0.5289660
amber-ff03,n,HIE,N,-0.6977970
amber-ff03,n,HIE,H1,0.4825990
amber-ff03,n,HIE,H2,0.4825990
amber-ff03,n,HIE,H3,0.4825990
amber-ff03,n,HIE,CA,0.1819260
amber-ff03,n,HIE,HA,0.0601250
amber-ff03,n,HIE,CB,-0.1148220
amber-ff03,n,HIE,HB2,0.0577210
amber-ff03,n,HIE,HB3,0.0577210
amber-ff03,n,HIE,CG,0.2099250
amber-ff03,n,HIE,ND1,-0.4866580
amber-ff03,n,HIE,CD2,-0.2586710
amber-ff03,n,HIE,HD2,0.1543350
amber-ff03,n,HIE,CE1,0.0554220
amber-ff03,n,HIE,HE1,0.1261780
amber-ff03,n,HIE,NE2,-0.0904170
amber-ff03,n,HIE,HE2,0.2819990
amber-ff03,n,HIE,C,0.6019060
amber-ff03,n,HIE,O,-0.5866940
amber-ff03,c,HIE,N,-0.6781070
amber-ff03,c,HIE,H,0.3786170
amber-ff03,c,HIE,CA,-0.0457620
amber-ff03,c,HIE,HA,0.1355890
amber-ff03,c,HIE,CB,-0.0882840
amber-ff03,c,HIE,HB2,0.0681970
amber-ff03,c,HIE,HB3,0.0681970
amber-ff03,c,HIE,CG,0.1978580
amber-ff03,c,HIE,ND1,-0.4763710
amber-ff03,c,HIE,CD2,-0.2548560
amber-ff03,c,HIE,HD2,0.1536590
amber-ff03,c,HIE,CE1,0.0488150
amber-ff03,c,HIE,HE1,0.1268610
amber-ff03,c,HIE,NE2,-0.0847780
amber-ff03,c,HIE,HE2,0.2803640
amber-ff03,c,HIE,C,0.5852090
amber-ff03,c,HIE,O,-0.7076050
amber-ff03,c,HIE,OXT,-0.7076050
amber-ff03,n-,HIE,N,-1.2151980
amber-ff03,n-,HIE,H1,0.4825990
amber-ff03,n-,HIE,H2,0.4825990
amber-ff03,n-,HIE,CA,0.1819260
amber-ff03,n-,HIE,HA,0.0601250
amber-ff03,n-,HIE,CB,-0.1148220
amber-ff03,n-,HIE,HB2,0.0577210
amber-ff03,n-,HIE,HB3,0.0577210
amber-ff03,n-,HIE,CG,0.2099250
amber-ff03,n-,HIE,ND1,-0.4866580
amber-ff03,n-,HIE,CD2,-0.2586710
amber-ff03,n-,HIE,HD2,0.1543350
amber-ff03,n-,HIE,CE1,0.0554220
amber-ff03,n-,HIE,HE1,0.1261780
amber-ff03,n-,HIE,NE2,-0.0904170
amber-ff03,n-,HIE,HE2,0.2819990
amber-ff03,n-,HIE,C,0.6019060
amber-ff03,n-,HIE,O,-0.5866940
amber-ff03,c+,HIE,N,-0.6781070
amber-ff03,c+,HIE,H,0.3786170
amber-ff03,c+,HIE,CA,-0.0457620
amber-ff03,c+,HIE,HA,0.1355890
amber-ff03,c+,HIE,CB,-0.0882840
amber-ff03,c+,HIE,HB2,0.0681970
amber-ff03,c+,HIE,HB3,0.0681970
amber-ff03,c+,HIE,CG,0.1978580
amber-ff03,c+,HIE,ND1,-0.4763710
amber-ff03,c+,HIE,CD2,-0.2548560
amber-ff03,c+,HIE,HD2,0.1536590
amber-ff03,c+,HIE,CE1,0.0488150
amber-ff03,c+,HIE,HE1,0.1268610
amber-ff03,c+,HIE,NE2,-0.0847780
amber-ff03,c+,HIE,HE2,0.2803640
amber-ff03,c+,HIE,C,0.5852090
amber-ff03,c+,HIE,O,-0.4314355
amber-ff03,c+,HIE,OXT,-0.4314355
amber-ff03,c+,HIE,HOXT,0.4476610
amber-ff03,m,HIP,N,-0.4249670
amber-ff03,m,HIP,H,0.2858730
amber-ff03,m,HIP,CA,0.3750220
amber-ff03,m,HIP,HA,-0.0146210
amber-ff03,m,HIP,CB,-0.3321230
amber-ff03,m,HIP,HB2,0.1077250
amber-ff03,m,HIP,HB3,0.1077250
amber-ff03,m,HIP,CG,0.1823990
amber-ff03,m,HIP,ND1,-0.0876020
amber-ff03,m,HIP,HD1,0.3050960
amber-ff03,m,HIP,CD2,-0.1920520
amber-ff03,m,HIP,HD2,0.2352370
amber-ff03,m,HIP,CE1,-0.0131050
amber-ff03,m,HIP,HE1,0.2306350
amber-ff03,m,HIP,NE2,-0.1487660
amber-ff03,m,HIP,HE2,0.3772950
amber-ff03,m,HIP,C,0.5666460
amber-ff03,m,HIP,O,-0.5604170
amber-ff03,n,HIP,N,-0.7452110
amber-ff03,n,HIP,H1,0.4984040
amber-ff03,n,HIP,H2,0.4984040
amber-ff03,n,HIP,H3,0.4984040
amber-ff03,n,HIP,CA,0.2237940
amber-ff03,n,HIP,HA,0.0295710
amber-ff03,n,HIP,CB,-0.0634940
amber-ff03,n,HIP,HB2,0.0894730
amber-ff03,n,HIP,HB3,0.0894730
amber-ff03,n,HIP,CG,-0.0054850
amber-ff03,n,HIP,ND1,-0.0146190
amber-ff03,n,HIP,HD1,0.2756680
amber-ff03,n,HIP,CD2,-0.1567710
amber-ff03,n,HIP,HD2,0.2214340
amber-ff03,n,HIP,CE1,-0.0204170
amber-ff03,n,HIP,HE1,0.2206610
amber-ff03,n,HIP,NE2,-0.1193880
amber-ff03,n,HIP,HE2,0.3635900
amber-ff03,n,HIP,C,0.7375120
amber-ff03,n,HIP,O,-0.6210000
amber-ff03,c,HIP,N,-0.4641930
amber-ff03,c,HIP,H,0.3153510
amber-ff03,c,HIP,CA,-0.0768710
amber-ff03,c,HIP,HA,0.1252190
amber-ff03,c,HIP,CB,-0.0628070
amber-ff03,c,HIP,HB2,0.0927940
amber-ff03,c,HIP,HB3,0.0927940
amber-ff03,c,HIP,CG,0.0578430
amber-ff03,c,HIP,ND1,-0.0150720
amber-ff03,c,HIP,HD1,0.2760760
amber-ff03,c,HIP,CD2,-0.1636360
amber-ff03,c,HIP,HD2,0.2204200
amber-ff03,c,HIP,CE1,-0.0334130
amber-ff03,c,HIP,HE1,0.2260490
amber-ff03,c,HIP,NE2,-0.1298080
amber-ff03,c,HIP,HE2,0.3692530
amber-ff03,c,HIP,C,0.5137570
amber-ff03,c,HIP,O,-0.6718790
amber-ff03,c,HIP,OXT,-0.6718790
amber-ff03,n-,HIP,N,-1.2468070
amber-ff03,n-,HIP,H1,0.4984040
amber-ff03,n-,HIP,H2,0.4984040
amber-ff03,n-,HIP,CA,0.2237940
amber-ff03,n-,HIP,HA,0.0295710
amber-ff03,n-,HIP,CB,-0.0634940
amber-ff03,n-,HIP,HB2,0.0894730
amber-ff03,n-,HIP,HB3,0.0894730
amber-ff03,n-,HIP,CG,-0.0054850
amber-ff03,n-,HIP,ND1,-0.0146190
amber-ff03,n-,HIP,HD1,0.2756680
amber-ff03,n-,HIP,CD2,-0.1567710
amber-ff03,n-,HIP,HD2,0.2214340
amber-ff03,n-,HIP,CE1,-0.0204170
amber-ff03,n-,HIP,HE1,0.2206610
amber-ff03,n-,HIP,NE2,-0.1193880
amber-ff03,n-,HIP,HE2,0.3635900
amber-ff03,n-,HIP,C,0.7375120
amber-ff03,n-,HIP,O,-0.6210000
amber-ff03,c+,HIP,N,-0.4641930
amber-ff03,c+,HIP,H,0.3153510
amber-ff03,c+,HIP,CA,-0.0768710
amber-ff03,c+,HIP,HA,0.1252190
amber-ff03,c+,HIP,CB,-0.0628070
amber-ff03,c+,HIP,HB2,0.0927940
amber-ff03,c+,HIP,HB3,0.0927940
amber-ff03,c+,HIP,CG,0.0578430
amber-ff03,c+,HIP,ND1,-0.0150720
amber-ff03,c+,HIP,HD1,0.2760760
amber-ff03,c+,HIP,CD2,-0.1636360
amber-ff03,c+,HIP,HD2,0.2204200
amber-ff03,c+,HIP,CE1,-0.0334130
amber-ff03,c+,HIP,HE1,0.2260490
amber-ff03,c+,HIP,NE2,-0.1298080
amber-ff03,c+,HIP,HE2,0.3692530
amber-ff03,c+,HIP,C,0.5137570
amber-ff03,c+,HIP,O,-0.3957095
amber-ff03,c+,HIP,OXT,-0.3957095
amber-ff03,c+,HIP,HOXT,0.4476610
amber-ff03,m,ILE,N,-0.4510470
amber-ff03,m,ILE,H,0.3288310
amber-ff03,m,ILE,CA,-0.1018740
amber-ff03,m,ILE,HA,0.1741930
amber-ff03,m,ILE,CB,0.0622380
amber-ff03,m,ILE,HB,0.0616620
amber-ff03,m,ILE,CG2,-0.1299890
amber-ff03,m,ILE,HG21,0.0302270
amber-ff03,m,ILE,HG22,0.0302270
amber-ff03,m,ILE,HG23,0.0302270
amber-ff03,m,ILE,CG1,0.0222300
amber-ff03,m,ILE,HG12,0.0115510
amber-ff03,m,ILE,HG13,0.0115510
amber-ff03,m,ILE,CD1,-0.1012510
amber-ff03,m,ILE,HD11,0.0237920
amber-ff03,m,ILE,HD12,0.0237920
amber-ff03,m,ILE,HD13,0.0237920
amber-ff03,m,ILE,C,0.5693830
amber-ff03,m,ILE,O,-0.6195350
amber-ff03,n,ILE,N,-0.6057570
amber-ff03,n,ILE,H1,0.4519190
amber-ff03,n,ILE,H2,0.4519190
amber-ff03,n,ILE,H3,0.4519190
amber-ff03,n,ILE,CA,0.0257680
amber-ff03,n,ILE,HA,0.0627540
amber-ff03,n,ILE,CB,0.0441980
amber-ff03,n,ILE,HB,0.0387040
amber-ff03,n,ILE,CG2,-0.1726720
amber-ff03,n,ILE,HG21,0.0385440
amber-ff03,n,ILE,HG22,0.0385440
amber-ff03,n,ILE,HG23,0.0385440
amber-ff03,n,ILE,CG1,0.0584470
amber-ff03,n,ILE,HG12,0.0036170
amber-ff03,n,ILE,HG13,0.0036170
amber-ff03,n,ILE,CD1,-0.1116090
amber-ff03,n,ILE,HD11,0.0256390
amber-ff03,n,ILE,HD12,0.0256390
amber-ff03,n,ILE,HD13,0.0256390
amber-ff03,n,ILE,C,0.7334450
amber-ff03,n,ILE,O,-0.6288200
amber-ff03,c,ILE,N,-0.5092700
amber-ff03,c,ILE,H,0.3145750
amber-ff03,c,ILE,CA,-0.2273330
amber-ff03,c,ILE,HA,0.1433040
amber-ff03,c,ILE,CB,0.0443650
amber-ff03,c,ILE,HB,0.0640010
amber-ff03,c,ILE,CG2,-0.1623780
amber-ff03,c,ILE,HG21,0.0400700
amber-ff03,c,ILE,HG22,0.0400700
amber-ff03,c,ILE,HG23,0.0400700
amber-ff03,c,ILE,CG1,0.0586580
amber-ff03,c,ILE,HG12,0.0088470
amber-ff03,c,ILE,HG13,0.0088470
amber-ff03,c,ILE,CD1,-0.1013760
amber-ff03,c,ILE,HD11,0.0225160
amber-ff03,c,ILE,HD12,0.0225160
amber-ff03,c,ILE,HD13,0.0225160
amber-ff03,c,ILE,C,0.6710340
amber-ff03,c,ILE,O,-0.7505170
amber-ff03,c,ILE,OXT,-0.7505170
amber-ff03,n-,ILE,N,-1.1538380
amber-ff03,n-,ILE,H1,0.4519190
amber-ff03,n-,ILE,H2,0.4519190
amber-ff03,n-,ILE,CA,0.0257680
amber-ff03,n-,ILE,HA,0.0627540
amber-ff03,n-,ILE,CB,0.0441980
amber-ff03,n-,ILE,HB,0.0387040
amber-ff03,n-,ILE,CG2,-0.1726720
amber-ff03,n-,ILE,HG21,0.0385440
amber-ff03,n-,ILE,HG22,0.0385440
amber-ff03,n-,ILE,HG23,0.0385440
amber-ff03,n-,ILE,CG1,0.0584470
amber-ff03,n-,ILE,HG12,0.0036170
amber-ff03,n-,ILE,HG13,0.0036170
amber-ff03,n-,ILE,CD1,-0.1116090
amber-ff03,n-,ILE,HD11,0.0256390
amber-ff03,n-,ILE,HD12,0.0256390
amber-ff03,n-,ILE,HD13,0.0256390
amber-ff03,n-,ILE,C,0.7334450
amber-ff03,n-,ILE,O,-0.6288200
amber-ff03,c+,ILE,N,-0.5092700
amber-ff03,c+,ILE,H,0.3145750
amber-ff03,c+,ILE,CA,-0.2273330
amber-ff03,c+,ILE,HA,0.1433040
amber-ff03,c+,ILE,CB,0.0443650
amber-ff03,c+,ILE,HB,0.0640010
amber-ff03,c+,ILE,CG2,-0.1623780
amber-ff03,c+,ILE,HG21,0.0400700
amber-ff03,c+,ILE,HG22,0.0400700
amber-ff03,c+,ILE,HG23,0.0400700
amber-ff03,c+,ILE,CG1,0.0586580
amber-ff03,c+,ILE,HG12,0.0088470
amber-ff03,c+,ILE,HG13,0.0088470
amber-ff03,c+,ILE,CD1,-0.1013760
amber-ff03,c+,ILE,HD11,0.0225160
amber-ff03,c+,ILE,HD12,0.0225160
amber-ff03,c+,ILE,HD13,0.0225160
amber-ff03,c+,ILE,C,0.6710340
amber-ff03,c+,ILE,O,-0.4743475
amber-ff03,c+,ILE,OXT,-0.4743475
amber-ff03,c+,ILE,HOXT,0.4476610
amber-ff03,m,LEU,N,-0.3551530
amber-ff03,m,LEU,H,0.2624170
amber-ff03,m,LEU,CA,-0.1014970
amber-ff03,m,LEU,HA,0.1369510
amber-ff03,m,LEU,CB,-0.1443990
amber-ff03,m,LEU,HB2,0.0525330
amber-ff03,m,LEU,HB3,0.0525330
amber-ff03,m,LEU,CG,0.1919820
amber-ff03,m,LEU,HG,0.0008250
amber-ff03,m,LEU,CD1,-0.1230360
amber-ff03,m,LEU,HD11,0.0223760
amber-ff03,m,LEU,HD12,0.0223760
amber-ff03,m,LEU,HD13,0.0223760
amber-ff03,m,LEU,CD2,-0.1230360
amber-ff03,m,LEU,HD21,0.0223760
amber-ff03,m,LEU,HD22,0.0223760
amber-ff03,m,LEU,HD23,0.0223760
amber-ff03,m,LEU,C,0.5734710
amber-ff03,m,LEU,O,-0.5578470
amber-ff03,n,LEU,N,-0.6247050
amber-ff03,n,LEU,H1,0.4582350
amber-ff03,n,LEU,H2,0.4582350
amber-ff03,n,LEU,H3,0.4582350
amber-ff03,n,LEU,CA,0.0698040
amber-ff03,n,LEU,HA,0.0923940
amber-ff03,n,LEU,CB,-0.1180190
amber-ff03,n,LEU,HB2,0.0376150
amber-ff03,n,LEU,HB3,0.0376150
amber-ff03,n,LEU,CG,0.1770990
amber-ff03,n,LEU,HG,0.0132720
amber-ff03,n,LEU,CD1,-0.1574140
amber-ff03,n,LEU,HD11,0.0319640
amber-ff03,n,LEU,HD12,0.0319640
amber-ff03,n,LEU,HD13,0.0319640
amber-ff03,n,LEU,CD2,-0.1574140
amber-ff03,n,LEU,HD21,0.0319640
amber-ff03,n,LEU,HD22,0.0319640
amber-ff03,n,LEU,HD23,0.0319640
amber-ff03,n,LEU,C,0.6565830
amber-ff03,n,LEU,O,-0.5933180
amber-ff03,c,LEU,N,-0.5565950
amber-ff03,c,LEU,H,0.3386720
amber-ff03,c,LEU,CA,-0.2298800
amber-ff03,c,LEU,HA,0.1907100
amber-ff03,c,LEU,CB,-0.1022130
amber-ff03,c,LEU,HB2,0.0548160
amber-ff03,c,LEU,HB3,0.0548160
amber-ff03,c,LEU,CG,0.1957140
amber-ff03,c,LEU,HG,0.0052860
amber-ff03,c,LEU,CD1,-0.1362250
amber-ff03,c,LEU,HD11,0.0251880
amber-ff03,c,LEU,HD12,0.0251880
amber-ff03,c,LEU,HD13,0.0251880
amber-ff03,c,LEU,CD2,-0.1362250
amber-ff03,c,LEU,HD21,0.0251880
amber-ff03,c,LEU,HD22,0.0251880
amber-ff03,c,LEU,HD23,0.0251880
amber-ff03,c,LEU,C,0.5984270
amber-ff03,c,LEU,O,-0.7142140
amber-ff03,c,LEU,OXT,-0.7142140
amber-ff03,n-,LEU,N,-1.1664700
amber-ff03,n-,LEU,H1,0.4582350
amber-ff03,n-,LEU,H2,0.4582350
amber-ff03,n-,LEU,CA,0.0698040
amber-ff03,n-,LEU,HA,0.0923940
amber-ff03,n-,LEU,CB,-0.1180190
amber-ff03,n-,LEU,HB2,0.0376150
amber-ff03,n-,LEU,HB3,0.0376150
amber-ff03,n-,LEU,CG,0.1770990
amber-ff03,n-,LEU,HG,0.0132720
amber-ff03,n-,LEU,CD1,-0.1574140
amber-ff03,n-,LEU,HD11,0.0319640
amber-ff03,n-,LEU,HD12,0.0319640
amber-ff03,n-,LEU,HD13,0.0319640
amber-ff03,n-,LEU,CD2,-0.1574140
amber-ff03,n-,LEU,HD21,0.0319640
amber-ff03,n-,LEU,HD22,0.0319640
amber-ff03,n-,LEU,HD23,0.0319640
amber-ff03,n-,LEU,C,0.6565830
amber-ff03,n-,LEU,O,-0.5933180
amber-ff03,c+,LEU,N,-0.5565950
amber-ff03,c+,LEU,H,0.3386720
amber-ff03,c+,LEU,CA,-0.2298800
amber-ff03,c+,LEU,HA,0.1907100
amber-ff03,c+,LEU,CB,-0.1022130
amber-ff03,c+,LEU,HB2,0.0548160
amber-ff03,c+,LEU,HB3,0.0548160
amber-ff03,c+,LEU,CG,0.1957140
amber-ff03,c+,LEU,HG,0.0052860
amber-ff03,c+,LEU,CD1,-0.1362250
amber-ff03,c+,LEU,HD11,0.0251880
amber-ff03,c+,LEU,HD12,0.0251880
amber-ff03,c+,LEU,HD13,0.0251880
amber-ff03,c+,LEU,CD2,-0.1362250
amber-ff03,c+,LEU,HD21,0.0251880
amber-ff03,c+,LEU,HD22,0.0251880
amber-ff03,c+,LEU,HD23,0.0251880
amber-ff03,c+,LEU,C,0.5984270
amber-ff03,c+,LEU,O,-0.4380445
amber-ff03,c+,LEU,OXT,-0.4380445
amber-ff03,c+,LEU,HOXT,0.4476610
amber-ff03,m,LYS,N,-0.4358750
amber-ff03,m,LYS,H,0.2513020
amber-ff03,m,LYS,CA,-0.0387730
amber-ff03,m,LYS,HA,0.1294780
amber-ff03,m,LYS,CB,-0.1082730
amber-ff03,m,LYS,HB2,0.0452140
amber-ff03,m,LYS,HB3,0.0452140
amber-ff03,m,LYS,CG,0.0333410
amber-ff03,m,LYS,HG2,0.0102080
amber-ff03,m,LYS,HG3,0.0102080
amber-ff03,m,LYS,CD,-0.0478410
amber-ff03,m,LYS,HD2,0.0707150
amber-ff03,m,LYS,HD3,0.0707150
amber-ff03,m,LYS,CE,-0.0699740
amber-ff03,m,LYS,HE2,0.1195220
amber-ff03,m,LYS,HE3,0.1195220
amber-ff03,m,LYS,NZ,-0.2503580
amber-ff03,m,LYS,HZ1,0.2945610
amber-ff03,m,LYS,HZ2,0.2945610
amber-ff03,m,LYS,HZ3,0.2945610
amber-ff03,m,LYS,C,0.7251290
amber-ff03,m,LYS,O,-0.5631570
amber-ff03,n,LYS,N,-0.7437780
amber-ff03,n,LYS,H1,0.4979260
amber-ff03,n,LYS,H2,0.4979260
amber-ff03,n,LYS,H3,0.4979260
amber-ff03,n,LYS,CA,0.1631150
amber-ff03,n,LYS,HA,0.0706710
amber-ff03,n,LYS,CB,-0.0447020
amber-ff03,n,LYS,HB2,0.0238150
amber-ff03,n,LYS,HB3,0.0238150
amber-ff03,n,LYS,CG,0.0070650
amber-ff03,n,LYS,HG2,0.0178810
amber-ff03,n,LYS,HG3,0.0178810
amber-ff03,n,LYS,CD,-0.0613570
amber-ff03,n,LYS,HD2,0.0657790
amber-ff03,n,LYS,HD3,0.0657790
amber-ff03,n,LYS,CE,-0.0290560
amber-ff03,n,LYS,HE2,0.1027720
amber-ff03,n,LYS,HE3,0.1027720
amber-ff03,n,LYS,NZ,-0.1818390
amber-ff03,n,LYS,HZ1,0.2895290
amber-ff03,n,LYS,HZ2,0.2895290
amber-ff03,n,LYS,HZ3,0.2895290
amber-ff03,n,LYS,C,0.6336670
amber-ff03,n,LYS,O,-0.5966450
amber-ff03,c,LYS,N,-0.6295690
amber-ff03,c,LYS,H,0.3574600
amber-ff03,c,LYS,CA,-0.0535410
amber-ff03,c,LYS,HA,0.1385440
amber-ff03,c,LYS,CB,-0.0460220
amber-ff03,c,LYS,HB2,0.0429120
amber-ff03,c,LYS,HB3,0.0429120
amber-ff03,c,LYS,CG,0.0202310
amber-ff03,c,LYS,HG2,0.0109710
amber-ff03,c,LYS,HG3,0.0109710
amber-ff03,c,LYS,CD,-0.0461650
amber-ff03,c,LYS,HD2,0.0614370
amber-ff03,c,LYS,HD3,0.0614370
amber-ff03,c,LYS,CE,-0.0327720
amber-ff03,c,LYS,HE2,0.1016540
amber-ff03,c,LYS,HE3,0.1016540
amber-ff03,c,LYS,NZ,-0.1686230
amber-ff03,c,LYS,HZ1,0.2855030
amber-ff03,c,LYS,HZ2,0.2855030
amber-ff03,c,LYS,HZ3,0.2855030
amber-ff03,c,LYS,C,0.5418180
amber-ff03,c,LYS,O,-0.6859090
amber-ff03,c,LYS,OXT,-0.6859090
amber-ff03,n-,LYS,N,-1.2458520
amber-ff03,n-,LYS,H1,0.4979260
amber-ff03,n-,LYS,H2,0.4979260
amber-ff03,n-,LYS,CA,0.1631150
amber-ff03,n-,LYS,HA,0.0706710
amber-ff03,n-,LYS,CB,-0.0447020
amber-ff03,n-,LYS,HB2,0.0238150
amber-ff03,n-,LYS,HB3,0.0238150
amber-ff03,n-,LYS,CG,0.0070650
amber-ff03,n-,LYS,HG2,0.0178810
amber-ff03,n-,LYS,HG3,0.0178810
amber-ff03,n-,LYS,CD,-0.0613570
amber-ff03,n-,LYS,HD2,0.0657790
amber-ff03,n-,LYS,HD3,0.0657790
amber-ff03,n-,LYS,CE,-0.0290560
amber-ff03,n-,LYS,HE2,0.1027720
amber-ff03,n-,LYS,HE3,0.1027720
amber-ff03,n-,LYS,NZ,-0.1818390
amber-ff03,n-,LYS,HZ1,0.2895290
amber-ff03,n-,LYS,HZ2,0.2895290
amber-ff03,n-,LYS,HZ3,0.2895290
amber-ff03,n-,LYS,C,0.6336670
amber-ff03,n-,LYS,O,-0.5966450
amber-ff03,c+,LYS,N,-0.6295690
amber-ff03,c+,LYS,H,0.3574600
amber-ff03,c+,LYS,CA,-0.0535410
amber-ff03,c+,LYS,HA,0.1385440
amber-ff03,c+,LYS,CB,-0.0460220
amber-ff03,c+,LYS,HB2,0.0429120
amber-ff03,c+,LYS,HB3,0.0429120
amber-ff03,c+,LYS,CG,0.0202310
amber-ff03,c+,LYS,HG2,0.0109710
amber-ff03,c+,LYS,HG3,0.0109710
amber-ff03,c+,LYS,CD,-0.0461650
amber-ff03,c+,LYS,HD2,0.0614370
amber-ff03,c+,LYS,HD3,0.0614370
amber-ff03,c+,LYS,CE,-0.0327720
amber-ff03,c+,LYS,HE2,0.1016540
amber-ff03,c+,LYS,HE3,0.1016540
amber-ff03,c+,LYS,NZ,-0.1686230
amber-ff03,c+,LYS,HZ1,0.2855030
amber-ff03,c+,LYS,HZ2,0.2855030
amber-ff03,c+,LYS,HZ3,0.2855030
amber-ff03,c+,LYS,C,0.5418180
amber-ff03,c+,LYS,O,-0.4097395
amber-ff03,c+,LYS,OXT,-0.4097395
amber-ff03,c+,LYS,HOXT,0.4476610
amber-ff03,m,LYN,N,-0.4533880
amber-ff03,m,LYN,H,0.2896950
amber-ff03,m,LYN,CA,-0.0245000
amber-ff03,m,LYN,HA,0.0995530
amber-ff03,m,LYN,CB,0.0354780
amber-ff03,m,LYN,HB2,0.0047970
amber-ff03,m,LYN,HB3,0.0047970
amber-ff03,m,LYN,CG,-0.0199620
amber-ff03,m,LYN,HG2,-0.0156100
amber-ff03,m,LYN,HG3,-0.0156100
amber-ff03,m,LYN,CD,0.0411050
amber-ff03,m,LYN,HD2,0.0083040
amber-ff03,m,LYN,HD3,0.0083040
amber-ff03,m,LYN,CE,0.1883820
amber-ff03,m,LYN,HE2,0.0168100
amber-ff03,m,LYN,HE3,0.0168100
amber-ff03,m,LYN,NZ,-0.8942540
amber-ff03,m,LYN,HZ1,0.3320530
amber-ff03,m,LYN,HZ2,0.3320530
amber-ff03,m,LYN,C,0.6084640
amber-ff03,m,LYN,O,-0.5632810
amber-ff03,n,LYN,N,-0.7437780
amber-ff03,n,LYN,H1,0.4979260
amber-ff03,n,LYN,H2,0.4979260
amber-ff03,n,LYN,H3,0.4979260
amber-ff03,n,LYN,CA,0.1631150
amber-ff03,n,LYN,HA,0.0706710
amber-ff03,n,LYN,CB,0.0354780
amber-ff03,n,LYN,HB2,0.0047970
amber-ff03,n,LYN,HB3,0.0047970
amber-ff03,n,LYN,CG,-0.0199620
amber-ff03,n,LYN,HG2,-0.0156100
amber-ff03,n,LYN,HG3,-0.0156100
amber-ff03,n,LYN,CD,0.0411050
amber-ff03,n,LYN,HD2,0.0083040
amber-ff03,n,LYN,HD3,0.0083040
amber-ff03,n,LYN,CE,0.1883820
amber-ff03,n,LYN,HE2,0.0168100
amber-ff03,n,LYN,HE3,0.0168100
amber-ff03,n,LYN,NZ,-0.9585190
amber-ff03,n,LYN,HZ1,0.3320530
amber-ff03,n,LYN,HZ2,0.3320530
amber-ff03,n,LYN,C,0.6336670
amber-ff03,n,LYN,O,-0.5966450
amber-ff03,c,LYN,N,-0.6295690
amber-ff03,c,LYN,H,0.3574600
amber-ff03,c,LYN,CA,-0.0535410
amber-ff03,c,LYN,HA,0.1385440
amber-ff03,c,LYN,CB,0.0354780
amber-ff03,c,LYN,HB2,0.0047970
amber-ff03,c,LYN,HB3,0.0047970
amber-ff03,c,LYN,CG,-0.0199620
amber-ff03,c,LYN,HG2,-0.0156100
amber-ff03,c,LYN,HG3,-0.0156100
amber-ff03,c,LYN,CD,0.0411050
amber-ff03,c,LYN,HD2,0.0083040
amber-ff03,c,LYN,HD3,0.0083040
amber-ff03,c,LYN,CE,0.1883820
amber-ff03,c,LYN,HE2,0.0168100
amber-ff03,c,LYN,HE3,0.0168100
amber-ff03,c,LYN,NZ,-0.9206050
amber-ff03,c,LYN,HZ1,0.3320530
amber-ff03,c,LYN,HZ2,0.3320530
amber-ff03,c,LYN,C,0.5418180
amber-ff03,c,LYN,O,-0.6859090
amber-ff03,c,LYN,OXT,-0.6859090
amber-ff03,n-,LYN,N,-1.2458520
amber-ff03,n-,LYN,H1,0.4979260
amber-ff03,n-,LYN,H2,0.4979260
amber-ff03,n-,LYN,CA,0.1631150
amber-ff03,n-,LYN,HA,0.0706710
amber-ff03,n-,LYN,CB,0.0354780
amber-ff03,n-,LYN,HB2,0.0047970
amber-ff03,n-,LYN,HB3,0.0047970
amber-ff03,n-,LYN,CG,-0.0199620
amber-ff03,n-,LYN,HG2,-0.0156100
amber-ff03,n-,LYN,HG3,-0.0156100
amber-ff03,n-,LYN,CD,0.0411050
amber-ff03,n-,LYN,HD2,0.0083040
amber-ff03,n-,LYN,HD3,0.0083040
amber-ff03,n-,LYN,CE,0.1883820
amber-ff03,n-,LYN,HE2,0.0168100
amber-ff03,n-,LYN,HE3,0.0168100
amber-ff03,n-,LYN,NZ,-0.9585190
amber-ff03,n-,LYN,HZ1,0.3320530
amber-ff03,n-,LYN,HZ2,0.3320530
amber-ff03,n-,LYN,C,0.6336670
amber-ff03,n-,LYN,O,-0.5966450
amber-ff03,c+,LYN,N,-0.6295690
amber-ff03,c+,LYN,H,0.3574600
amber-ff03,c+,LYN,CA,-0.0535410
amber-ff03,c+,LYN,HA,0.1385440
amber-ff03,c+,LYN,CB,0.0354780
amber-ff03,c+,LYN,HB2,0.0047970
amber-ff03,c+,LYN,HB3,0.0047970
amber-ff03,c+,LYN,CG,-0.0199620
amber-ff03,c+,LYN,HG2,-0.0156100
amber-ff03,c+,LYN,HG3,-0.0156100
amber-ff03,c+,LYN,CD,0.0411050
amber-ff03,c+,LYN,HD2,0.0083040
amber-ff03,c+,LYN,HD3,0.0083040
amber-ff03,c+,LYN,CE,0.1883820
amber-ff03,c+,LYN,HE2,0.0168100
amber-ff03,c+,LYN,HE3,0.0168100
amber-ff03,c+,LYN,NZ,-0.9206050
amber-ff03,c+,LYN,HZ1,0.3320530
amber-ff03,c+,LYN,HZ2,0.3320530
amber-ff03,c+,LYN,C,0.5418180
amber-ff03,c+,LYN,O,-0.4097395
amber-ff03,c+,LYN,OXT,-0.4097395
amber-ff03,c+,LYN,HOXT,0.4476610
amber-ff03,m,MET,N,-0.3949180
amber-ff03,m,MET,H,0.2805370
amber-ff03,m,MET,CA,-0.0876810
amber-ff03,m,MET,HA,0.1230800
amber-ff03,m,MET,CB,0.0192270
amber-ff03,m,MET,HB2,0.0488400
amber-ff03,m,MET,HB3,0.0488400
amber-ff03,m,MET,CG,-0.2081670
amber-ff03,m,MET,HG2,0.1242280
amber-ff03,m,MET,HG3,0.1242280
amber-ff03,m,MET,SD,-0.2119580
amber-ff03,m,MET,CE,-0.2846980
amber-ff03,m,MET,HE1,0.1283940
amber-ff03,m,MET,HE2,0.1283940
amber-ff03,m,MET,HE3,0.1283940
amber-ff03,m,MET,C,0.5996840
amber-ff03,m,MET,O,-0.5664240
amber-ff03,n,MET,N,-0.5972130
amber-ff03,n,MET,H1,0.4490710
amber-ff03,n,MET,H2,0.4490710
amber-ff03,n,MET,H3,0.4490710
amber-ff03,n,MET,CA,0.0609060
amber-ff03,n,MET,HA,0.0754210
amber-ff03,n,MET,CB,0.0515230
amber-ff03,n,MET,HB2,0.0389260
amber-ff03,n,MET,HB3,0.0389260
amber-ff03,n,MET,CG,-0.2543860
amber-ff03,n,MET,HG2,0.1295170
amber-ff03,n,MET,HG3,0.1295170
amber-ff03,n,MET,SD,-0.2068520
amber-ff03,n,MET,CE,-0.2843580
amber-ff03,n,MET,HE1,0.1287540
amber-ff03,n,MET,HE2,0.1287540
amber-ff03,n,MET,HE3,0.1287540
amber-ff03,n,MET,C,0.6836390
amber-ff03,n,MET,O,-0.5990420
amber-ff03,c,MET,N,-0.5642460
amber-ff03,c,MET,H,0.3344120
amber-ff03,c,MET,CA,-0.1598820
amber-ff03,c,MET,HA,0.1428330
amber-ff03,c,MET,CB,0.0583640
amber-ff03,c,MET,HB2,0.0524790
amber-ff03,c,MET,HB3,0.0524790
amber-ff03,c,MET,CG,-0.2303520
amber-ff03,c,MET,HG2,0.1279830
amber-ff03,c,MET,HG3,0.1279830
amber-ff03,c,MET,SD,-0.2185700
amber-ff03,c,MET,CE,-0.2625710
amber-ff03,c,MET,HE1,0.1230310
amber-ff03,c,MET,HE2,0.1230310
amber-ff03,c,MET,HE3,0.1230310
amber-ff03,c,MET,C,0.6649180
amber-ff03,c,MET,O,-0.7474590
amber-ff03,c,MET,OXT,-0.7474590
amber-ff03,n-,MET,N,-1.1481420
amber-ff03,n-,MET,H1,0.4490710
amber-ff03,n-,MET,H2,0.4490710
amber-ff03,n-,MET,CA,0.0609060
amber-ff03,n-,MET,HA,0.0754210
amber-ff03,n-,MET,CB,0.0515230
amber-ff03,n-,MET,HB2,0.0389260
amber-ff03,n-,MET,HB3,0.0389260
amber-ff03,n-,MET,CG,-0.2543860
amber-ff03,n-,MET,HG2,0.1295170
amber-ff03,n-,MET,HG3,0.1295170
amber-ff03,n-,MET,SD,-0.2068520
amber-ff03,n-,MET,CE,-0.2843580
amber-ff03,n-,MET,HE1,0.1287540
amber-ff03,n-,MET,HE2,0.1287540
amber-ff03,n-,MET,HE3,0.1287540
amber-ff03,n-,MET,C,0.6836390
amber-ff03,n-,MET,O,-0.5990420
amber-ff03,c+,MET,N,-0.5642460
amber-ff03,c+,MET,H,0.3344120
amber-ff03,c+,MET,CA,-0.1598820
amber-ff03,c+,MET,HA,0.1428330
amber-ff03,c+,MET,CB,0.0583640
amber-ff03,c+,MET,HB2,0.0524790
amber-ff03,c+,MET,HB3,0.0524790
amber-ff03,c+,MET,CG,-0.2303520
amber-ff03,c+,MET,HG2,0.1279830
amber-ff03,c+,MET,HG3,0.1279830
amber-ff03,c+,MET,SD,-0.2185700
amber-ff03,c+,MET,CE,-0.2625710
amber-ff03,c+,MET,HE1,0.1230310
amber-ff03,c+,MET,HE2,0.1230310
amber-ff03,c+,MET,HE3,0.1230310
amber-ff03,c+,MET,C,0.6649180
amber-ff03,c+,MET,O,-0.4712900
amber-ff03,c+,MET,OXT,-0.4712900
amber-ff03,c+,MET,HOXT,0.4476610
amber-ff03,m,PHE,N,-0.3712900
amber-ff03,m,PHE,H,0.2340530
amber-ff03,m,PHE,CA,-0.0300570
amber-ff03,m,PHE,HA,0.1024480
amber-ff03,m,PHE,CB,-0.0987200
amber-ff03,m,PHE,HB2,0.0609890
amber-ff03,m,PHE,HB3,0.0609890
amber-ff03,m,PHE,CG,0.0213130
amber-ff03,m,PHE,CD1,-0.0831090
amber-ff03,m,PHE,HD1,0.0984660
amber-ff03,m,PHE,CD2,-0.0831090
amber-ff03,m,PHE,HD2,0.0984660
amber-ff03,m,PHE,CE1,-0.1569740
amber-ff03,m,PHE,HE1,0.1237310
amber-ff03,m,PHE,CE2,-0.1569740
amber-ff03,m,PHE,HE2,0.1237310
amber-ff03,m,PHE,CZ,-0.0998240
amber-ff03,m,PHE,HZ,0.1146790
amber-ff03,m,PHE,C,0.5479870
amber-ff03,m,PHE,O,-0.5067950
amber-ff03,n,PHE,N,-0.6294940
amber-ff03,n,PHE,H1,0.4598310
amber-ff03,n,PHE,H2,0.4598310
amber-ff03,n,PHE,H3,0.4598310
amber-ff03,n,PHE,CA,0.1750180
amber-ff03,n,PHE,HA,0.0515300
amber-ff03,n,PHE,CB,-0.0565970
amber-ff03,n,PHE,HB2,0.0443310
amber-ff03,n,PHE,HB3,0.0443310
amber-ff03,n,PHE,CG,0.0008270
amber-ff03,n,PHE,CD1,-0.1015290
amber-ff03,n,PHE,HD1,0.1086100
amber-ff03,n,PHE,CD2,-0.1015290
amber-ff03,n,PHE,HD2,0.1086100
amber-ff03,n,PHE,CE1,-0.1563410
amber-ff03,n,PHE,HE1,0.1283460
amber-ff03,n,PHE,CE2,-0.1563410
amber-ff03,n,PHE,HE2,0.1283460
amber-ff03,n,PHE,CZ,-0.1047910
amber-ff03,n,PHE,HZ,0.1190840
amber-ff03,n,PHE,C,0.5961180
amber-ff03,n,PHE,O,-0.5780210
amber-ff03,c,PHE,N,-0.6255620
amber-ff03,c,PHE,H,0.3498980
amber-ff03,c,PHE,CA,-0.0881820
amber-ff03,c,PHE,HA,0.1349540
amber-ff03,c,PHE,CB,-0.0575830
amber-ff03,c,PHE,HB2,0.0640410
amber-ff03,c,PHE,HB3,0.0640410
amber-ff03,c,PHE,CG,0.0079910
amber-ff03,c,PHE,CD1,-0.0989640
amber-ff03,c,PHE,HD1,0.1121200
amber-ff03,c,PHE,CD2,-0.0989640
amber-ff03,c,PHE,HD2,0.1121200
amber-ff03,c,PHE,CE1,-0.1611360
amber-ff03,c,PHE,HE1,0.1281270
amber-ff03,c,PHE,CE2,-0.1611360
amber-ff03,c,PHE,HE2,0.1281270
amber-ff03,c,PHE,CZ,-0.0973750
amber-ff03,c,PHE,HZ,0.1174810
amber-ff03,c,PHE,C,0.5955190
amber-ff03,c,PHE,O,-0.7127600
amber-ff03,c,PHE,OXT,-0.7127600
amber-ff03,n-,PHE,N,-1.1696630
amber-ff03,n-,PHE,H1,0.4598310
amber-ff03,n-,PHE,H2,0.4598310
amber-ff03,n-,PHE,CA,0.1750180
amber-ff03,n-,PHE,HA,0.0515300
amber-ff03,n-,PHE,CB,-0.0565970
amber-ff03,n-,PHE,HB2,0.0443310
amber-ff03,n-,PHE,HB3,0.0443310
amber-ff03,n-,PHE,CG,0.0008270
amber-ff03,n-,PHE,CD1,-0.1015290
amber-ff03,n-,PHE,HD1,0.1086100
amber-ff03,n-,PHE,CD2,-0.1015290
amber-ff03,n-,PHE,HD2,0.1086100
amber-ff03,n-,PHE,CE1,-0.1563410
amber-ff03,n-,PHE,HE1,0.1283460
amber-ff03,n-,PHE,CE2,-0.1563410
amber-ff03,n-,PHE,HE2,0.1283460
amber-ff03,n-,PHE,CZ,-0.1047910
amber-ff03,n-,PHE,HZ,0.1190840
amber-ff03,n-,PHE,C,0.5961180
amber-ff03,n-,PHE,O,-0.5780210
amber-ff03,c+,PHE,N,-0.6255620
amber-ff03,c+,PHE,H,0.3498980
amber-ff03,c+,PHE,CA,-0.0881820
amber-ff03,c+,PHE,HA,0.1349540
amber-ff03,c+,PHE,CB,-0.0575830
amber-ff03,c+,PHE,HB2,0.0640410
amber-ff03,c+,PHE,HB3,0.0640410
amber-ff03,c+,PHE,CG,0.0079910
amber-ff03,c+,PHE,CD1,-0.0989640
amber-ff03,c+,PHE,HD1,0.1121200
amber-ff03,c+,PHE,CD2,-0.0989640
amber-ff03,c+,PHE,HD2,0.1121200
amber-ff03,c+,PHE,CE1,-0.1611360
amber-ff03,c+,PHE,HE1,0.1281270
amber-ff03,c+,PHE,CE2,-0.1611360
amber-ff03,c+,PHE,HE2,0.1281270
amber-ff03,c+,PHE,CZ,-0.0973750
amber-ff03,c+,PHE,HZ,0.1174810
amber-ff03,c+,PHE,C,0.5955190
amber-ff03,c+,PHE,O,-0.4365910
amber-ff03,c+,PHE,OXT,-0.4365910
amber-ff03,c+,PHE,HOXT,0.4476610
amber-ff03,m,PRO,N,-0.0881160
amber-ff03,m,PRO,CA,-0.0345770
amber-ff03,m,PRO,CB,-0.0033510
amber-ff03,m,PRO,CG,0.0130590
amber-ff03,m,PRO,CD,-0.0119060
amber-ff03,m,PRO,HA,0.0599770
amber-ff03,m,PRO,HB2,0.0193520
amber-ff03,m,PRO,HB3,0.0193520
amber-ff03,m,PRO,HG2,0.0195740
amber-ff03,m,PRO,HG3,0.0195740
amber-ff03,m,PRO,HD2,0.0439510
amber-ff03,m,PRO,HD3,0.0439510
amber-ff03,m,PRO,C,0.3337200
amber-ff03,m,PRO,O,-0.4345590
amber-ff03,n,PRO,N,-0.4217390
amber-ff03,n,PRO,H2,0.4718570
amber-ff03,n,PRO,H3,0.4718570
amber-ff03,n,PRO,CA,0.2519860
amber-ff03,n,PRO,CB,-0.1233050
amber-ff03,n,PRO,CG,0.1060810
amber-ff03,n,PRO,CD,0.0484860
amber-ff03,n,PRO,HA,-0.0217150
amber-ff03,n,PRO,HB2,0.0283550
amber-ff03,n,PRO,HB3,0.0283550
amber-ff03,n,PRO,HG2,-0.0006320
amber-ff03,n,PRO,HG3,-0.0006320
amber-ff03,n,PRO,HD2,0.0399010
amber-ff03,n,PRO,HD3,0.0399010
amber-ff03,n,PRO,C,0.6804700
amber-ff03,n,PRO,O,-0.5992260
amber-ff03,c,PRO,N,-0.2687420
amber-ff03,c,PRO,CA,-0.3854420
amber-ff03,c,PRO,CB,0.0657730
amber-ff03,c,PRO,CG,0.0598790
amber-ff03,c,PRO,CD,0.0622850
amber-ff03,c,PRO,HA,0.1779380
amber-ff03,c,PRO,HB2,0.0168890
amber-ff03,c,PRO,HB3,0.0168890
amber-ff03,c,PRO,HG2,0.0075480
amber-ff03,c,PRO,HG3,0.0075480
amber-ff03,c,PRO,HD2,0.0347170
amber-ff03,c,PRO,HD3,0.0347170
amber-ff03,c,PRO,C,0.6433210
amber-ff03,c,PRO,O,-0.7366610
amber-ff03,c,PRO,OXT,-0.7366610
amber-ff03,n-,PRO,N,-0.9498820
amber-ff03,n-,PRO,H2,0.4718570
amber-ff03,n-,PRO,CA,0.2519860
amber-ff03,n-,PRO,CB,-0.1233050
amber-ff03,n-,PRO,CG,0.1060810
amber-ff03,n-,PRO,CD,0.0484860
amber-ff03,n-,PRO,HA,-0.0217150
amber-ff03,n-,PRO,HB2,0.0283550
amber-ff03,n-,PRO,HB3,0.0283550
amber-ff03,n-,PRO,HG2,-0.0006320
amber-ff03,n-,PRO,HG3,-0.0006320
amber-ff03,n-,PRO,HD2,0.0399010
amber-ff03,n-,PRO,HD3,0.0399010
amber-ff03,n-,PRO,C,0.6804700
amber-ff03,n-,PRO,O,-0.5992260
amber-ff03,c+,PRO,N,-0.2687420
amber-ff03,c+,PRO,CA,-0.3854420
amber-ff03,c+,PRO,CB,0.0657730
amber-ff03,c+,PRO,CG,0.0598790
amber-ff03,c+,PRO,CD,0.0622850
amber-ff03,c+,PRO,HA,0.1779380
amber-ff03,c+,PRO,HB2,0.0168890
amber-ff03,c+,PRO,HB3,0.0168890
amber-ff03,c+,PRO,HG2,0.0075480
amber-ff03,c+,PRO,HG3,0.0075480
amber-ff03,c+,PRO,HD2,0.0347170
amber-ff03,c+,PRO,HD3,0.0347170
amber-ff03,c+,PRO,C,0.6433210
amber-ff03,c+,PRO,O,-0.4604920
amber-ff03,c+,PRO,OXT,-0.4604920
amber-ff03,c+,PRO,HOXT,0.4476610
amber-ff03,m,SER,N,-0.5414300
amber-ff03,m,SER,H,0.3454150
amber-ff03,m,SER,CA,0.1181400
amber-ff03,m,SER,HA,0.1421770
amber-ff03,m,SER,CB,0.1469980
amber-ff03,m,SER,HB2,0.0400810
amber-ff03,m,SER,HB3,0.0400810
amber-ff03,m,SER,OG,-0.6403120
amber-ff03,m,SER,HG,0.4462550
amber-ff03,m,SER,C,0.4834240
amber-ff03,m,SER,O,-0.5808290
amber-ff03,n,SER,N,-0.6644030
amber-ff03,n,SER,H1,0.4714680
amber-ff03,n,SER,H2,0.4714680
amber-ff03,n,SER,H3,0.4714680
amber-ff03,n,SER,CA,0.1402900
amber-ff03,n,SER,HA,0.0911500
amber-ff03,n,SER,CB,0.1119870
amber-ff03,n,SER,HB2,0.0392850
amber-ff03,n,SER,HB3,0.0392850
amber-ff03,n,SER,OG,-0.5938050
amber-ff03,n,SER,HG,0.4074920
amber-ff03,n,SER,C,0.5924800
amber-ff03,n,SER,O,-0.5781620
amber-ff03,c,SER,N,-0.6762810
amber-ff03,c,SER,H,0.3692390
amber-ff03,c,SER,CA,-0.0723850
amber-ff03,c,SER,HA,0.1581850
amber-ff03,c,SER,CB,0.1329640
amber-ff03,c,SER,HB2,0.0480080
amber-ff03,c,SER,HB3,0.0480080
amber-ff03,c,SER,OG,-0.5804790
amber-ff03,c,SER,HG,0.4027420
amber-ff03,c,SER,C,0.5943670
amber-ff03,c,SER,O,-0.7121840
amber-ff03,c,SER,OXT,-0.7121840
amber-ff03,n-,SER,N,-1.1929380
amber-ff03,n-,SER,H1,0.4714680
amber-ff03,n-,SER,H2,0.4714680
amber-ff03,n-,SER,CA,0.1402900
amber-ff03,n-,SER,HA,0.0911500
amber-ff03,n-,SER,CB,0.1119870
amber-ff03,n-,SER,HB2,0.0392850
amber-ff03,n-,SER,HB3,0.0392850
amber-ff03,n-,SER,OG,-0.5938050
amber-ff03,n-,SER,HG,0.4074920
amber-ff03,n-,SER,C,0.5924800
amber-ff03,n-,SER,O,-0.5781620
amber-ff03,c+,SER,N,-0.6762810
amber-ff03,c+,SER,H,0.3692390
amber-ff03,c+,SER,CA,-0.0723850
amber-ff03,c+,SER,HA,0.1581850
amber-ff03,c+,SER,CB,0.1329640
amber-ff03,c+,SER,HB2,0.0480080
amber-ff03,c+,SER,HB3,0.0480080
amber-ff03,c+,SER,OG,-0.5804790
amber-ff03,c+,SER,HG,0.4027420
amber-ff03,c+,SER,C,0.5943670
amber-ff03,c+,SER,O,-0.4360150
amber-ff03,c+,SER,OXT,-0.4360150
amber-ff03,c+,SER,HOXT,0.4476610
amber-ff03,m,THR,N,-0.2453820
amber-ff03,m,THR,H,0.2553390
amber-ff03,m,THR,CA,-0.2712490
amber-ff03,m,THR,HA,0.1637570
amber-ff03,m,THR,CB,0.2378680
amber-ff03,m,THR,HB,0.0446880
amber-ff03,m,THR,OG1,-0.6019310
amber-ff03,m,THR,HG1,0.4054840
amber-ff03,m,THR,CG2,-0.1764890
amber-ff03,m,THR,HG21,0.0600190
amber-ff03,m,THR,HG22,0.0600190
amber-ff03,m,THR,HG23,0.0600190
amber-ff03,m,THR,C,0.5598780
amber-ff03,m,THR,O,-0.5520200
amber-ff03,n,THR,N,-0.5702350
amber-ff03,n,THR,H1,0.4400780
amber-ff03,n,THR,H2,0.4400780
amber-ff03,n,THR,H3,0.4400780
amber-ff03,n,THR,CA,0.0287540
amber-ff03,n,THR,HA,0.0785380
amber-ff03,n,THR,CB,0.2709410
amber-ff03,n,THR,HB,-0.0144760
amber-ff03,n,THR,OG1,-0.6219340
amber-ff03,n,THR,HG1,0.4091670
amber-ff03,n,THR,CG2,-0.1606570
amber-ff03,n,THR,HG21,0.0538330
amber-ff03,n,THR,HG22,0.0538330
amber-ff03,n,THR,HG23,0.0538330
amber-ff03,n,THR,C,0.7099680
amber-ff03,n,THR,O,-0.6117970
amber-ff03,c,THR,N,-0.3516680
amber-ff03,c,THR,H,0.2993200
amber-ff03,c,THR,CA,-0.5005690
amber-ff03,c,THR,HA,0.2376580
amber-ff03,c,THR,CB,0.2944220
amber-ff03,c,THR,HB,0.0311480
amber-ff03,c,THR,OG1,-0.6055680
amber-ff03,c,THR,HG1,0.4086460
amber-ff03,c,THR,CG2,-0.1371630
amber-ff03,c,THR,HG21,0.0512580
amber-ff03,c,THR,HG22,0.0512580
amber-ff03,c,THR,HG23,0.0512580
amber-ff03,c,THR,C,0.6816690
amber-ff03,c,THR,O,-0.7558350
amber-ff03,c,THR,OXT,-0.7558350
amber-ff03,n-,THR,N,-1.1301590
amber-ff03,n-,THR,H1,0.4400780
amber-ff03,n-,THR,H2,0.4400780
amber-ff03,n-,THR,CA,0.0287540
amber-ff03,n-,THR,HA,0.0785380
amber-ff03,n-,THR,CB,0.2709410
amber-ff03,n-,THR,HB,-0.0144760
amber-ff03,n-,THR,OG1,-0.6219340
amber-ff03,n-,THR,HG1,0.4091670
amber-ff03,n-,THR,CG2,-0.1606570
amber-ff03,n-,THR,HG21,0.0538330
amber-ff03,n-,THR,HG22,0.0538330
amber-ff03,n-,THR,HG23,0.0538330
amber-ff03,n-,THR,C,0.7099680
amber-ff03,n-,THR,O,-0.6117970
amber-ff03,c+,THR,N,-0.3516680
amber-ff03,c+,THR,H,0.2993200
amber-ff03,c+,THR,CA,-0.5005690
amber-ff03,c+,THR,HA,0.2376580
amber-ff03,c+,THR,CB,0.2944220
amber-ff03,c+,THR,HB,0.0311480
amber-ff03,c+,THR,OG1,-0.6055680
amber-ff03,c+,THR,HG1,0.4086460
amber-ff03,c+,THR,CG2,-0.1371630
amber-ff03,c+,THR,HG21,0.0512580
amber-ff03,c+,THR,HG22,0.0512580
amber-ff03,c+,THR,HG23,0.0512580
amber-ff03,c+,THR,C,0.6816690
amber-ff03,c+,THR,O,-0.4796650
amber-ff03,c+,THR,OXT,-0.4796650
amber-ff03,c+,THR,HOXT,0.4476610
amber-ff03,m,TRP,N,-0.4275790
amber-ff03,m,TRP,H,0.2417160
amber-ff03,m,TRP,CA,-0.0200820
amber-ff03,m,TRP,HA,0.1066290
amber-ff03,m,TRP,CB,-0.0983640
amber-ff03,m,TRP,HB2,0.0654240
amber-ff03,m,TRP,HB3,0.0654240
amber-ff03,m,TRP,CG,-0.0997970
amber-ff03,m,TRP,CD1,-0.1740530
amber-ff03,m,TRP,HD1,0.1706330
amber-ff03,m,TRP,NE1,-0.2984330
amber-ff03,m,TRP,HE1,0.3223750
amber-ff03,m,TRP,CE2,0.1415230
amber-ff03,m,TRP,CD2,0.0896410
amber-ff03,m,TRP,CE3,-0.1539920
amber-ff03,m,TRP,HE3,0.1230840
amber-ff03,m,TRP,CZ2,-0.2107010
amber-ff03,m,TRP,HZ2,0.1255120
amber-ff03,m,TRP,CZ3,-0.1640540
amber-ff03,m,TRP,HZ3,0.1192500
amber-ff03,m,TRP,CH2,-0.1330220
amber-ff03,m,TRP,HH2,0.1194670
amber-ff03,m,TRP,C,0.5841290
amber-ff03,m,TRP,O,-0.4947300
amber-ff03,n,TRP,N,-0.6219790
amber-ff03,n,TRP,H1,0.4573260
amber-ff03,n,TRP,H2,0.4573260
amber-ff03,n,TRP,H3,0.4573260
amber-ff03,n,TRP,CA,0.1179190
amber-ff03,n,TRP,HA,0.0732470
amber-ff03,n,TRP,CB,-0.0532190
amber-ff03,n,TRP,HB2,0.0552730
amber-ff03,n,TRP,HB3,0.0552730
amber-ff03,n,TRP,CG,-0.1440900
amber-ff03,n,TRP,CD1,-0.1721040
amber-ff03,n,TRP,HD1,0.1795000
amber-ff03,n,TRP,NE1,-0.3000890
amber-ff03,n,TRP,HE1,0.3435460
amber-ff03,n,TRP,CE2,0.1452330
amber-ff03,n,TRP,CD2,0.0838290
amber-ff03,n,TRP,CE3,-0.1702850
amber-ff03,n,TRP,HE3,0.1359630
amber-ff03,n,TRP,CZ2,-0.2209330
amber-ff03,n,TRP,HZ2,0.1359700
amber-ff03,n,TRP,CZ3,-0.1773710
amber-ff03,n,TRP,HZ3,0.1223460
amber-ff03,n,TRP,CH2,-0.1390290
amber-ff03,n,TRP,HH2,0.1231180
amber-ff03,n,TRP,C,0.6264600
amber-ff03,n,TRP,O,-0.5705570
amber-ff03,c,TRP,N,-0.6299740
amber-ff03,c,TRP,H,0.3412280
amber-ff03,c,TRP,CA,-0.0442500
amber-ff03,c,TRP,HA,0.1284360
amber-ff03,c,TRP,CB,-0.0583720
amber-ff03,c,TRP,HB2,0.0695900
amber-ff03,c,TRP,HB3,0.0695900
amber-ff03,c,TRP,CG,-0.1463440
amber-ff03,c,TRP,CD1,-0.1680760
amber-ff03,c,TRP,HD1,0.1786860
amber-ff03,c,TRP,NE1,-0.3019700
amber-ff03,c,TRP,HE1,0.3440320
amber-ff03,c,TRP,CE2,0.1434470
amber-ff03,c,TRP,CD2,0.1020280
amber-ff03,c,TRP,CE3,-0.1878470
amber-ff03,c,TRP,HE3,0.1430530
amber-ff03,c,TRP,CZ2,-0.2231940
amber-ff03,c,TRP,HZ2,0.1367240
amber-ff03,c,TRP,CZ3,-0.1732230
amber-ff03,c,TRP,HZ3,0.1216340
amber-ff03,c,TRP,CH2,-0.1376730
amber-ff03,c,TRP,HH2,0.1224740
amber-ff03,c,TRP,C,0.6155690
amber-ff03,c,TRP,O,-0.7227850
amber-ff03,c,TRP,OXT,-0.7227850
amber-ff03,n-,TRP,N,-1.1646530
amber-ff03,n-,TRP,H1,0.4573260
amber-ff03,n-,TRP,H2,0.4573260
amber-ff03,n-,TRP,CA,0.1179190
amber-ff03,n-,TRP,HA,0.0732470
amber-ff03,n-,TRP,CB,-0.0532190
amber-ff03,n-,TRP,HB2,0.0552730
amber-ff03,n-,TRP,HB3,0.0552730
amber-ff03,n-,TRP,CG,-0.1440900
amber-ff03,n-,TRP,CD1,-0.1721040
amber-ff03,n-,TRP,HD1,0.1795000
amber-ff03,n-,TRP,NE1,-0.3000890
amber-ff03,n-,TRP,HE1,0.3435460
amber-ff03,n-,TRP,CE2,0.1452330
amber-ff03,n-,TRP,CD2,0.0838290
amber-ff03,n-,TRP,CE3,-0.1702850
amber-ff03,n-,TRP,HE3,0.1359630
amber-ff03,n-,TRP,CZ2,-0.2209330
amber-ff03,n-,TRP,HZ2,0.1359700
amber-ff03,n-,TRP,CZ3,-0.1773710
amber-ff03,n-,TRP,HZ3,0.1223460
amber-ff03,n-,TRP,CH2,-0.1390290
amber-ff03,n-,TRP,HH2,0.1231180
amber-ff03,n-,TRP,C,0.6264600
amber-ff03,n-,TRP,O,-0.5705570
amber-ff03,c+,TRP,N,-0.6299740
amber-ff03,c+,TRP,H,0.3412280
amber-ff03,c+,TRP,CA,-0.0442500
amber-ff03,c+,TRP,HA,0.1284360
amber-ff03,c+,TRP,CB,-0.0583720
amber-ff03,c+,TRP,HB2,0.0695900
amber-ff03,c+,TRP,HB3,0.0695900
amber-ff03,c+,TRP,CG,-0.1463440
amber-ff03,c+,TRP,CD1,-0.1680760
amber-ff03,c+,TRP,HD1,0.1786860
amber-ff03,c+,TRP,NE1,-0.3019700
amber-ff03,c+,TRP,HE1,0.3440320
amber-ff03,c+,TRP,CE2,0.1434470
amber-ff03,c+,TRP,CD2,0.1020280
amber-ff03,c+,TRP,CE3,-0.1878470
amber-ff03,c+,TRP,HE3,0.1430530
amber-ff03,c+,TRP,CZ2,-0.2231940
amber-ff03,c+,TRP,HZ2,0.1367240
amber-ff03,c+,TRP,CZ3,-0.1732230
amber-ff03,c+,TRP,HZ3,0.1216340
amber-ff03,c+,TRP,CH2,-0.1376730
amber-ff03,c+,TRP,HH2,0.1224740
amber-ff03,c+,TRP,C,0.6155690
amber-ff03,c+,TRP,O,-0.4466160
amber-ff03,c+,TRP,OXT,-0.4466160
amber-ff03,c+,TRP,HOXT,0.4476610
amber-ff03,m,TYR,N,-0.4875600
amber-ff03,m,TYR,H,0.2635210
amber-ff03,m,TYR,CA,0.0096140
amber-ff03,m,TYR,HA,0.0955010
amber-ff03,m,TYR,CB,-0.0518530
amber-ff03,m,TYR,HB2,0.0191450
amber-ff03,m,TYR,HB3,0.0191450
amber-ff03,m,TYR,CG,0.1126010
amber-ff03,m,TYR,CD1,-0.1834610
amber-ff03,m,TYR,HD1,0.1327150
amber-ff03,m,TYR,CE1,-0.1818230
amber-ff03,m,TYR,HE1,0.1373030
amber-ff03,m,TYR,CD2,-0.1834610
amber-ff03,m,TYR,HD2,0.1327150
amber-ff03,m,TYR,CE2,-0.1818230
amber-ff03,m,TYR,HE2,0.1373030
amber-ff03,m,TYR,CZ,0.2062770
amber-ff03,m,TYR,OH,-0.4212330
amber-ff03,m,TYR,HH,0.3296910
amber-ff03,m,TYR,C,0.6222900
amber-ff03,m,TYR,O,-0.5266070
amber-ff03,n,TYR,N,-0.5928490
amber-ff03,n,TYR,H1,0.4476160
amber-ff03,n,TYR,H2,0.4476160
amber-ff03,n,TYR,H3,0.4476160
amber-ff03,n,TYR,CA,0.0906520
amber-ff03,n,TYR,HA,0.1132650
amber-ff03,n,TYR,CB,-0.0507050
amber-ff03,n,TYR,HB2,0.0064410
amber-ff03,n,TYR,HB3,0.0064410
amber-ff03,n,TYR,CG,0.1309090
amber-ff03,n,TYR,CD1,-0.1982820
amber-ff03,n,TYR,HD1,0.1482460
amber-ff03,n,TYR,CE1,-0.2138630
amber-ff03,n,TYR,HE1,0.1480900
amber-ff03,n,TYR,CD2,-0.1982820
amber-ff03,n,TYR,HD2,0.1482460
amber-ff03,n,TYR,CE2,-0.2138630
amber-ff03,n,TYR,HE2,0.1480900
amber-ff03,n,TYR,CZ,0.2426290
amber-ff03,n,TYR,OH,-0.4753870
amber-ff03,n,TYR,HH,0.3707820
amber-ff03,n,TYR,C,0.6208930
amber-ff03,n,TYR,O,-0.5743010
amber-ff03,c,TYR,N,-0.6756280
amber-ff03,c,TYR,H,0.3504480
amber-ff03,c,TYR,CA,-0.0127280
amber-ff03,c,TYR,HA,0.1468710
amber-ff03,c,TYR,CB,-0.0580780
amber-ff03,c,TYR,HB2,0.0166190
amber-ff03,c,TYR,HB3,0.0166190
amber-ff03,c,TYR,CG,0.1330180
amber-ff03,c,TYR,CD1,-0.1946750
amber-ff03,c,TYR,HD1,0.1499170
amber-ff03,c,TYR,CE1,-0.2188200
amber-ff03,c,TYR,HE1,0.1486920
amber-ff03,c,TYR,CD2,-0.1946750
amber-ff03,c,TYR,HD2,0.1499170
amber-ff03,c,TYR,CE2,-0.2188200
amber-ff03,c,TYR,HE2,0.1486920
amber-ff03,c,TYR,CZ,0.2477340
amber-ff03,c,TYR,OH,-0.4751200
amber-ff03,c,TYR,HH,0.3700160
amber-ff03,c,TYR,C,0.6655550
amber-ff03,c,TYR,O,-0.7477780
amber-ff03,c,TYR,OXT,-0.7477780
amber-ff03,n-,TYR,N,-1.1452330
amber-ff03,n-,TYR,H1,0.4476160
amber-ff03,n-,TYR,H2,0.4476160
amber-ff03,n-,TYR,CA,0.0906520
amber-ff03,n-,TYR,HA,0.1132650
amber-ff03,n-,TYR,CB,-0.0507050
amber-ff03,n-,TYR,HB2,0.0064410
amber-ff03,n-,TYR,HB3,0.0064410
amber-ff03,n-,TYR,CG,0.1309090
amber-ff03,n-,TYR,CD1,-0.1982820
amber-ff03,n-,TYR,HD1,0.1482460
amber-ff03,n-,TYR,CE1,-0.2138630
amber-ff03,n-,TYR,HE1,0.1480900
amber-ff03,n-,TYR,CD2,-0.1982820
amber-ff03,n-,TYR,HD2,0.1482460
amber-ff03,n-,TYR,CE2,-0.2138630
amber-ff03,n-,TYR,HE2,0.1480900
amber-ff03,n-,TYR,CZ,0.2426290
amber-ff03,n-,TYR,OH,-0.4753870
amber-ff03,n-,TYR,HH,0.3707820
amber-ff03,n-,TYR,C,0.6208930
amber-ff03,n-,TYR,O,-0.5743010
amber-ff03,c+,TYR,N,-0.6756280
amber-ff03,c+,TYR,H,0.3504480
amber-ff03,c+,TYR,CA,-0.0127280
amber-ff03,c+,TYR,HA,0.1468710
amber-ff03,c+,TYR,CB,-0.0580780
amber-ff03,c+,TYR,HB2,0.0166190
amber-ff03,c+,TYR,HB3,0.0166190
amber-ff03,c+,TYR,CG,0.1330180
amber-ff03,c+,TYR,CD1,-0.1946750
amber-ff03,c+,TYR,HD1,0.1499170
amber-ff03,c+,TYR,CE1,-0.2188200
amber-ff03,c+,TYR,HE1,0.1486920
amber-ff03,c+,TYR,CD2,-0.1946750
amber-ff03,c+,TYR,HD2,0.1499170
amber-ff03,c+,TYR,CE2,-0.2188200
amber-ff03,c+,TYR,HE2,0.1486920
amber-ff03,c+,TYR,CZ,0.2477340
amber-ff03,c+,TYR,OH,-0.4751200
amber-ff03,c+,TYR,HH,0.3700160
amber-ff03,c+,TYR,C,0.6655550
amber-ff03,c+,TYR,O,-0.4716090
amber-ff03,c+,TYR,OXT,-0.4716090
amber-ff03,c+,TYR,HOXT,0.4476610
amber-ff03,m,TYM,N,-0.4875600
amber-ff03,m,TYM,H,0.2635210
amber-ff03,m,TYM,CA,0.0096140
amber-ff03,m,TYM,HA,0.0955010
amber-ff03,m,TYM,CB,-0.0518530
amber-ff03,m,TYM,HB2,0.0191450
amber-ff03,m,TYM,HB3,0.0191450
amber-ff03,m,TYM,CG,0.0568170
amber-ff03,m,TYM,CD1,-0.2117990
amber-ff03,m,TYM,HD1,0.1327150
amber-ff03,m,TYM,CE1,-0.2376070
amber-ff03,m,TYM,HE1,0.1373030
amber-ff03,m,TYM,CD2,-0.2117990
amber-ff03,m,TYM,HD2,0.1327150
amber-ff03,m,TYM,CE2,-0.2376070
amber-ff03,m,TYM,HE2,0.1373030
amber-ff03,m,TYM,CZ,0.2062770
amber-ff03,m,TYM,OH,-0.8675110
amber-ff03,m,TYM,C,0.6222900
amber-ff03,m,TYM,O,-0.5266070
amber-ff03,n,TYM,N,-0.5928490
amber-ff03,n,TYM,H1,0.4476160
amber-ff03,n,TYM,H2,0.4476160
amber-ff03,n,TYM,H3,0.4476160
amber-ff03,n,TYM,CA,0.0906520
amber-ff03,n,TYM,HA,0.1132650
amber-ff03,n,TYM,CB,-0.0518530
amber-ff03,n,TYM,HB2,0.0191450
amber-ff03,n,TYM,HB3,0.0191450
amber-ff03,n,TYM,CG,0.0568170
amber-ff03,n,TYM,CD1,-0.2117990
amber-ff03,n,TYM,HD1,0.1327150
amber-ff03,n,TYM,CE1,-0.2376070
amber-ff03,n,TYM,HE1,0.1373030
amber-ff03,n,TYM,CD2,-0.2117990
amber-ff03,n,TYM,HD2,0.1327150
amber-ff03,n,TYM,CE2,-0.2376070
amber-ff03,n,TYM,HE2,0.1373030
amber-ff03,n,TYM,CZ,0.2062770
amber-ff03,n,TYM,OH,-0.8912630
amber-ff03,n,TYM,C,0.6208930
amber-ff03,n,TYM,O,-0.5743010
amber-ff03,c,TYM,N,-0.6756280
amber-ff03,c,TYM,H,0.3504480
amber-ff03,c,TYM,CA,-0.0127280
amber-ff03,c,TYM,HA,0.1468710
amber-ff03,c,TYM,CB,-0.0518530
amber-ff03,c,TYM,HB2,0.0191450
amber-ff03,c,TYM,HB3,0.0191450
amber-ff03,c,TYM,CG,0.0568170
amber-ff03,c,TYM,CD1,-0.2117990
amber-ff03,c,TYM,HD1,0.1327150
amber-ff03,c,TYM,CE1,-0.2376070
amber-ff03,c,TYM,HE1,0.1373030
amber-ff03,c,TYM,CD2,-0.2117990
amber-ff03,c,TYM,HD2,0.1327150
amber-ff03,c,TYM,CE2,-0.2376070
amber-ff03,c,TYM,HE2,0.1373030
amber-ff03,c,TYM,CZ,0.2062770
amber-ff03,c,TYM,OH,-0.8697170
amber-ff03,c,TYM,C,0.6655550
amber-ff03,c,TYM,O,-0.7477780
amber-ff03,c,TYM,OXT,-0.7477780
amber-ff03,n-,TYM,N,-1.1452330
amber-ff03,n-,TYM,H1,0.4476160
amber-ff03,n-,TYM,H2,0.4476160
amber-ff03,n-,TYM,CA,0.0906520
amber-ff03,n-,TYM,HA,0.1132650
amber-ff03,n-,TYM,CB,-0.0518530
amber-ff03,n-,TYM,HB2,0.0191450
amber-ff03,n-,TYM,HB3,0.0191450
amber-ff03,n-,TYM,CG,0.0568170
amber-ff03,n-,TYM,CD1,-0.2117990
amber-ff03,n-,TYM,HD1,0.1327150
amber-ff03,n-,TYM,CE1,-0.2376070
amber-ff03,n-,TYM,HE1,0.1373030
amber-ff03,n-,TYM,CD2,-0.2117990
amber-ff03,n-,TYM,HD2,0.1327150
amber-ff03,n-,TYM,CE2,-0.2376070
amber-ff03,n-,TYM,HE2,0.1373030
amber-ff03,n-,TYM,CZ,0.2062770
amber-ff03,n-,TYM,OH,-0.8912630
amber-ff03,n-,TYM,C,0.6208930
amber-ff03,n-,TYM,O,-0.5743010
amber-ff03,c+,TYM,N,-0.6756280
amber-ff03,c+,TYM,H,0.3504480
amber-ff03,c+,TYM,CA,-0.0127280
amber-ff03,c+,TYM,HA,0.1468710
amber-ff03,c+,TYM,CB,-0.0518530
amber-ff03,c+,TYM,HB2,0.0191450
amber-ff03,c+,TYM,HB3,0.0191450
amber-ff03,c+,TYM,CG,0.0568170
amber-ff03,c+,TYM,CD1,-0.2117990
amber-ff03,c+,TYM,HD1,0.1327150
amber-ff03,c+,TYM,CE1,-0.2376070
amber-ff03,c+,TYM,HE1,0.1373030
amber-ff03,c+,TYM,CD2,-0.2117990
amber-ff03,c+,TYM,HD2,0.1327150
amber-ff03,c+,TYM,CE2,-0.2376070
amber-ff03,c+,TYM,HE2,0.1373030
amber-ff03,c+,TYM,CZ,0.2062770
amber-ff03,c+,TYM,OH,-0.8697170
amber-ff03,c+,TYM,C,0.6655550
amber-ff03,c+,TYM,O,-0.4716085
amber-ff03,c+,TYM,OXT,-0.4716085
amber-ff03,c+,TYM,HOXT,0.4476610
amber-ff03,m,VAL,N,-0.4500870
amber-ff03,m,VAL,H,0.4400480
amber-ff03,m,VAL,CA,-0.0518580
amber-ff03,m,VAL,HA,-0.0262040
amber-ff03,m,VAL,CB,0.3952170
amber-ff03,m,VAL,HB,-0.1156720
amber-ff03,m,VAL,CG1,-0.0901320
amber-ff03,m,VAL,HG11,-0.0089850
amber-ff03,m,VAL,HG12,-0.0089850
amber-ff03,m,VAL,HG13,-0.0089850
amber-ff03,m,VAL,CG2,-0.0901320
amber-ff03,m,VAL,HG21,-0.0089850
amber-ff03,m,VAL,HG22,-0.0089850
amber-ff03,m,VAL,HG23,-0.0089850
amber-ff03,m,VAL,C,0.4473590
amber-ff03,m,VAL,O,-0.4046290
amber-ff03,n,VAL,N,-0.7374500
amber-ff03,n,VAL,H1,0.4958170
amber-ff03,n,VAL,H2,0.4958170
amber-ff03,n,VAL,H3,0.4958170
amber-ff03,n,VAL,CA,-0.0828370
amber-ff03,n,VAL,HA,0.0170070
amber-ff03,n,VAL,CB,0.2408870
amber-ff03,n,VAL,HB,-0.0346740
amber-ff03,n,VAL,CG1,-0.2091300
amber-ff03,n,VAL,HG11,0.0431240
amber-ff03,n,VAL,HG12,0.0431240
amber-ff03,n,VAL,HG13,0.0431240
amber-ff03,n,VAL,CG2,-0.2091300
amber-ff03,n,VAL,HG21,0.0431240
amber-ff03,n,VAL,HG22,0.0431240
amber-ff03,n,VAL,HG23,0.0431240
amber-ff03,n,VAL,C,0.8906410
amber-ff03,n,VAL,O,-0.6215110
amber-ff03,c,VAL,N,-0.2170540
amber-ff03,c,VAL,H,0.2431220
amber-ff03,c,VAL,CA,-0.3741200
amber-ff03,c,VAL,HA,0.0977200
amber-ff03,c,VAL,CB,0.2023090
amber-ff03,c,VAL,HB,-0.0229530
amber-ff03,c,VAL,CG1,-0.1377960
amber-ff03,c,VAL,HG11,0.0294280
amber-ff03,c,VAL,HG12,0.0294280
amber-ff03,c,VAL,HG13,0.0294280
amber-ff03,c,VAL,CG2,-0.1377960
amber-ff03,c,VAL,HG21,0.0294280
amber-ff03,c,VAL,HG22,0.0294280
amber-ff03,c,VAL,HG23,0.0294280
amber-ff03,c,VAL,C,0.5256160
amber-ff03,c,VAL,O,-0.6778080
amber-ff03,c,VAL,OXT,-0.6778080
amber-ff03,n-,VAL,N,-1.2416330
amber-ff03,n-,VAL,H1,0.4958170
amber-ff03,n-,VAL,H2,0.4958170
amber-ff03,n-,VAL,CA,-0.0828370
amber-ff03,n-,VAL,HA,0.0170070
amber-ff03,n-,VAL,CB,0.2408870
amber-ff03,n-,VAL,HB,-0.0346740
amber-ff03,n-,VAL,CG1,-0.2091300
amber-ff03,n-,VAL,HG11,0.0431240
amber-ff03,n-,VAL,HG12,0.0431240
amber-ff03,n-,VAL,HG13,0.0431240
amber-ff03,n-,VAL,CG2,-0.2091300
amber-ff03,n-,VAL,HG21,0.0431240
amber-ff03,n-,VAL,HG22,0.0431240
amber-ff03,n-,VAL,HG23,0.0431240
amber-ff03,n-,VAL,C,0.8906410
amber-ff03,n-,VAL,O,-0.6215110
amber-ff03,c+,VAL,N,-0.2170540
amber-ff03,c+,VAL,H,0.2431220
amber-ff03,c+,VAL,CA,-0.3741200
amber-ff03,c+,VAL,HA,0.0977200
amber-ff03,c+,VAL,CB,0.2023090
amber-ff03,c+,VAL,HB,-0.0229530
amber-ff03,c+,VAL,CG1,-0.1377960
amber-ff03,c+,VAL,HG11,0.0294280
amber-ff03,c+,VAL,HG12,0.0294280
amber-ff03,c+,VAL,HG13,0.0294280
amber-ff03,c+,VAL,CG2,-0.1377960
amber-ff03,c+,VAL,HG21,0.0294280
amber-ff03,c+,VAL,HG22,0.0294280
amber-ff03,c+,VAL,HG23,0.0294280
amber-ff03,c+,VAL,C,0.5256160
amber-ff03,c+,VAL,O,-0.4016385
amber-ff03,c+,VAL,OXT,-0.4016385
amber-ff03,c+,VAL,HOXT,0.4476610
charmm,m,ALA,N,-0.4700000
charmm,m,ALA,H,0.3100000
charmm,m,ALA,CA,0.0700000
charmm,m,ALA,HA,0.0900000
charmm,m,ALA,CB,-0.2700000
charmm,m,ALA,HB1,0.0900000
charmm,m,ALA,HB2,0.0900000
charmm,m,ALA,HB3,0.0900000
charmm,m,ALA,C,0.5100000
charmm,m,ALA,O,-0.5100000
charmm,n,ALA,N,-0.3000000
charmm,n,ALA,H1,0.3300000
charmm,n,ALA,H2,0.3300000
charmm,n,ALA,H3,0.3300000
charmm,n,ALA,CA,0.2100000
charmm,n,ALA,HA,0.1000000
charmm,n,ALA,CB,-0.2700000
charmm,n,ALA,HB1,0.0900000
charmm,n,ALA,HB2,0.0900000
charmm,n,ALA,HB3,0.0900000
charmm,n,ALA,C,0.5100000
charmm,n,ALA,O,-0.5100000
charmm,c,ALA,N,-0.4700000
charmm,c,ALA,H,0.3100000
charmm,c,ALA,CA,0.0700000
charmm,c,ALA,HA,0.0900000
charmm,c,ALA,CB,-0.2700000
charmm,c,ALA,HB1,0.0900000
charmm,c,ALA,HB2,0.0900000
charmm,c,ALA,HB3,0.0900000
charmm,c,ALA,C,0.3400000
charmm,c,ALA,O,-0.6700000
charmm,c,ALA,OXT,-0.6700000
charmm,n-,ALA,N,-0.9600000
charmm,n-,ALA,H1,0.3400000
charmm,n-,ALA,H2,0.3400000
charmm,n-,ALA,CA,0.1900000
charmm,n-,ALA,HA,0.0900000
charmm,n-,ALA,CB,-0.2700000
charmm,n-,ALA,HB1,0.0900000
charmm,n-,ALA,HB2,0.0900000
charmm,n-,ALA,HB3,0.0900000
charmm,n-,ALA,C,0.5100000
charmm,n-,ALA,O,-0.5100000
charmm,c+,ALA,N,-0.4700000
charmm,c+,ALA,H,0.3100000
charmm,c+,ALA,CA,0.0700000
charmm,c+,ALA,HA,0.0900000
charmm,c+,ALA,CB,-0.2700000
charmm,c+,ALA,HB1,0.0900000
charmm,c+,ALA,HB2,0.0900000
charmm,c+,ALA,HB3,0.0900000
charmm,c+,ALA,C,0.7200000
charmm,c+,ALA,O,-0.5500000
charmm,c+,ALA,OXT,-0.6100000
charmm,c+,ALA,HOXT,0.4400000
charmm,m,ARG,N,-0.4700000
charmm,m,ARG,H,0.3100000
charmm,m,ARG,CA,0.0700000
charmm,m,ARG,HA,0.0900000
charmm,m,ARG,CB,-0.1800000
charmm,m,ARG,HB2,0.0900000
charmm,m,ARG,HB3,0.0900000
charmm,m,ARG,CG,-0.1800000
charmm,m,ARG,HG2,0.0900000
charmm,m,ARG,HG3,0.0900000
charmm,m,ARG,CD,0.2000000
charmm,m,ARG,HD2,0.0900000
charmm,m,ARG,HD3,0.0900000
charmm,m,ARG,NE,-0.7000000
charmm,m,ARG,HE,0.4400000
charmm,m,ARG,CZ,0.6400000
charmm,m,ARG,NH1,-0.8000000
charmm,m,ARG,HH11,0.4600000
charmm,m,ARG,HH12,0.4600000
charmm,m,ARG,NH2,-0.8000000
charmm,m,ARG,HH21,0.4600000
charmm,m,ARG,HH22,0.4600000
charmm,m,ARG,C,0.5100000
charmm,m,ARG,O,-0.5100000
charmm,n,ARG,N,-0.3000000
charmm,n,ARG,H1,0.3300000
charmm,n,ARG,H2,0.3300000
charmm,n,ARG,H3,0.3300000
charmm,n,ARG,CA,0.2100000
charmm,n,ARG,HA,0.1000000
charmm,n,ARG,CB,-0.1800000
charmm,n,ARG,HB2,0.0900000
charmm,n,ARG,HB3,0.0900000
charmm,n,ARG,CG,-0.1800000
charmm,n,ARG,HG2,0.0900000
charmm,n,ARG,HG3,0.0900000
charmm,n,ARG,CD,0.2000000
charmm,n,ARG,HD2,0.0900000
charmm,n,ARG,HD3,0.0900000
charmm,n,ARG,NE,-0.7000000
charmm,n,ARG,HE,0.4400000
charmm,n,ARG,CZ,0.6400000
charmm,n,ARG,NH1,-0.8000000
charmm,n,ARG,HH11,0.4600000
charmm,n,ARG,HH12,0.4600000
charmm,n,ARG,NH2,-0.8000000
charmm,n,ARG,HH21,0.4600000
charmm,n,ARG,HH22,0.4600000
charmm,n,ARG,C,0.5100000
charmm,n,ARG,O,-0.5100000
charmm,c,ARG,N,-0.4700000
charmm,c,ARG,H,0.3100000
charmm,c,ARG,CA,0.0700000
charmm,c,ARG,HA,0.0900000
charmm,c,ARG,CB,-0.1800000
charmm,c,ARG,HB2,0.0900000
charmm,c,ARG,HB3,0.0900000
charmm,c,ARG,CG,-0.1800000
charmm,c,ARG,HG2,0.0900000
charmm,c,ARG,HG3,0.0900000
charmm,c,ARG,CD,0.2000000
charmm,c,ARG,HD2,0.0900000
charmm,c,ARG,HD3,0.0900000
charmm,c,ARG,NE,-0.7000000
charmm,c,ARG,HE,0.4400000
charmm,c,ARG,CZ,0.6400000
charmm,c,ARG,NH1,-0.8000000
charmm,c,ARG,HH11,0.4600000
charmm,c,ARG,HH12,0.4600000
charmm,c,ARG,NH2,-0.8000000
charmm,c,ARG,HH21,0.4600000
charmm,c,ARG,HH22,0.4600000
charmm,c,ARG,C,0.3400000
charmm,c,ARG,O,-0.6700000
charmm,c,ARG,OXT,-0.6700000
charmm,n-,ARG,N,-0.9600000
charmm,n-,ARG,H1,0.3400000
charmm,n-,ARG,H2,0.3400000
charmm,n-,ARG,CA,0.1900000
charmm,n-,ARG,HA,0.0900000
charmm,n-,ARG,CB,-0.1800000
charmm,n-,ARG,HB2,0.0900000
charmm,n-,ARG,HB3,0.0900000
charmm,n-,ARG,CG,-0.1800000
charmm,n-,ARG,HG2,0.0900000
charmm,n-,ARG,HG3,0.0900000
charmm,n-,ARG,CD,0.2000000
charmm,n-,ARG,HD2,0.0900000
charmm,n-,ARG,HD3,0.0900000
charmm,n-,ARG,NE,-0.7000000
charmm,n-,ARG,HE,0.4400000
charmm,n-,ARG,CZ,0.6400000
charmm,n-,ARG,NH1,-0.8000000
charmm,n-,ARG,HH11,0.4600000
charmm,n-,ARG,HH12,0.4600000
charmm,n-,ARG,NH2,-0.8000000
charmm,n-,ARG,HH21,0.4600000
charmm,n-,ARG,HH22,0.4600000
charmm,n-,ARG,C,0.5100000
charmm,n-,ARG,O,-0.5100000
charmm,c+,ARG,N,-0.4700000
charmm,c+,ARG,H,0.3100000
charmm,c+,ARG,CA,0.0700000
charmm,c+,ARG,HA,0.0900000
charmm,c+,ARG,CB,-0.1800000
charmm,c+,ARG,HB2,0.0900000
charmm,c+,ARG,HB3,0.0900000
charmm,c+,ARG,CG,-0.1800000
charmm,c+,ARG,HG2,0.0900000
charmm,c+,ARG,HG3,0.0900000
charmm,c+,ARG,CD,0.2000000
charmm,c+,ARG,HD2,0.0900000
charmm,c+,ARG,HD3,0.0900000
charmm,c+,ARG,NE,-0.7000000
charmm,c+,ARG,HE,0.4400000
charmm,c+,ARG,CZ,0.6400000
charmm,c+,ARG,NH1,-0.8000000
charmm,c+,ARG,HH11,0.4600000
charmm,c+,ARG,HH12,0.4600000
charmm,c+,ARG,NH2,-0.8000000
charmm,c+,ARG,HH21,0.4600000
charmm,c+,ARG,HH22,0.4600000
charmm,c+,ARG,C,0.7200000
charmm,c+,ARG,O,-0.5500000
charmm,c+,ARG,OXT,-0.6100000
charmm,c+,ARG,HOXT,0.4400000
charmm,m,ARN,N,-0.4700000
charmm,m,ARN,H,0.3100000
charmm,m,ARN,CA,0.0700000
charmm,m,ARN,HA,0.0900000
charmm,m,ARN,CB,-0.1800000
charmm,m,ARN,HB2,0.0900000
charmm,m,ARN,HB3,0.0900000
charmm,m,ARN,CG,-0.1800000
charmm,m,ARN,HG2,0.0900000
charmm,m,ARN,HG3,0.0900000
charmm,m,ARN,CD,0.2000000
charmm,m,ARN,HD2,0.0900000
charmm,m,ARN,HD3,0.0900000
charmm,m,ARN,NE,-0.6600000
charmm,m,ARN,HE,0.3600000
charmm,m,ARN,CZ,0.3200000
charmm,m,ARN,NH1,-0.7600000
charmm,m,ARN,HH11,0.3800000
charmm,m,ARN,HH12,0.3800000
charmm,m,ARN,NH2,-0.7500000
charmm,m,ARN,HH21,0.3500000
charmm,m,ARN,C,0.5100000
charmm,m,ARN,O,-0.5100000
charmm,n,ARN,N,-0.3000000
charmm,n,ARN,H1,0.3300000
charmm,n,ARN,H2,0.3300000
charmm,n,ARN,H3,0.3300000
charmm,n,ARN,CA,0.2100000
charmm,n,ARN,HA,0.1000000
charmm,n,ARN,CB,-0.1800000
charmm,n,ARN,HB2,0.0900000
charmm,n,ARN,HB3,0.0900000
charmm,n,ARN,CG,-0.1800000
charmm,n,ARN,HG2,0.0900000
charmm,n,ARN,HG3,0.0900000
charmm,n,ARN,CD,0.2000000
charmm,n,ARN,HD2,0.0900000
charmm,n,ARN,HD3,0.0900000
charmm,n,ARN,NE,-0.6600000
charmm,n,ARN,HE,0.3600000
charmm,n,ARN,CZ,0.3200000
charmm,n,ARN,NH1,-0.7600000
charmm,n,ARN,HH11,0.3800000
charmm,n,ARN,HH12,0.3800000
charmm,n,ARN,NH2,-0.7500000
charmm,n,ARN,HH21,0.3500000
charmm,n,ARN,C,0.5100000
charmm,n,ARN,O,-0.5100000
charmm,c,ARN,N,-0.4700000
charmm,c,ARN,H,0.3100000
charmm,c,ARN,CA,0.0700000
charmm,c,ARN,HA,0.0900000
charmm,c,ARN,CB,-0.1800000
charmm,c,ARN,HB2,0.0900000
charmm,c,ARN,HB3,0.0900000
charmm,c,ARN,CG,-0.1800000
charmm,c,ARN,HG2,0.0900000
charmm,c,ARN,HG3,0.0900000
charmm,c,ARN,CD,0.2000000
charmm,c,ARN,HD2,0.0900000
charmm,c,ARN,HD3,0.0900000
charmm,c,ARN,NE,-0.6600000
charmm,c,ARN,HE,0.3600000
charmm,c,ARN,CZ,0.3200000
charmm,c,ARN,NH1,-0.7600000
charmm,c,ARN,HH11,0.3800000
charmm,c,ARN,HH12,0.3800000
charmm,c,ARN,NH2,-0.7500000
charmm,c,ARN,HH21,0.3500000
charmm,c,ARN,C,0.3400000
charmm,c,ARN,O,-0.6700000
charmm,c,ARN,OXT,-0.6700000
charmm,n-,ARN,N,-0.9600000
charmm,n-,ARN,H1,0.3400000
charmm,n-,ARN,H2,0.3400000
charmm,n-,ARN,CA,0.1900000
charmm,n-,ARN,HA,0.0900000
charmm,n-,ARN,CB,-0.1800000
charmm,n-,ARN,HB2,0.0900000
charmm,n-,ARN,HB3,0.0900000
charmm,n-,ARN,CG,-0.1800000
charmm,n-,ARN,HG2,0.0900000
charmm,n-,ARN,HG3,0.0900000
charmm,n-,ARN,CD,0.2000000
charmm,n-,ARN,HD2,0.0900000
charmm,n-,ARN,HD3,0.0900000
charmm,n-,ARN,NE,-0.6600000
charmm,n-,ARN,HE,0.3600000
charmm,n-,ARN,CZ,0.3200000
charmm,n-,ARN,NH1,-0.7600000
charmm,n-,ARN,HH11,0.3800000
charmm,n-,ARN,HH12,0.3800000
charmm,n-,ARN,NH2,-0.7500000
charmm,n-,ARN,HH21,0.3500000
charmm,n-,ARN,C,0.5100000
charmm,n-,ARN,O,-0.5100000
charmm,c+,ARN,N,-0.4700000
charmm,c+,ARN,H,0.3100000
charmm,c+,ARN,CA,0.0700000
charmm,c+,ARN,HA,0.0900000
charmm,c+,ARN,CB,-0.1800000
charmm,c+,ARN,HB2,0.0900000
charmm,c+,ARN,HB3,0.0900000
charmm,c+,ARN,CG,-0.1800000
charmm,c+,ARN,HG2,0.0900000
charmm,c+,ARN,HG3,0.0900000
charmm,c+,ARN,CD,0.2000000
charmm,c+,ARN,HD2,0.0900000
charmm,c+,ARN,HD3,0.0900000
charmm,c+,ARN,NE,-0.6600000
charmm,c+,ARN,HE,0.3600000
charmm,c+,ARN,CZ,0.3200000
charmm,c+,ARN,NH1,-0.7600000
charmm,c+,ARN,HH11,0.3800000
charmm,c+,ARN,HH12,0.3800000
charmm,c+,ARN,NH2,-0.7500000
charmm,c+,ARN,HH21,0.3500000
charmm,c+,ARN,C,0.7200000
charmm,c+,ARN,O,-0.5500000
charmm,c+,ARN,OXT,-0.6100000
charmm,c+,ARN,HOXT,0.4400000
charmm,m,ASN,N,-0.4700000
charmm,m,ASN,H,0.3100000
charmm,m,ASN,CA,0.0700000
charmm,m,ASN,HA,0.0900000
charmm,m,ASN,CB,-0.1800000
charmm,m,ASN,HB2,0.0900000
charmm,m,ASN,HB3,0.0900000
charmm,m,ASN,CG,0.5500000
charmm,m,ASN,OD1,-0.5500000
charmm,m,ASN,ND2,-0.6200000
charmm,m,ASN,HD21,0.3200000
charmm,m,ASN,HD22,0.3000000
charmm,m,ASN,C,0.5100000
charmm,m,ASN,O,-0.5100000
charmm,n,ASN,N,-0.3000000
charmm,n,ASN,H1,0.3300000
charmm,n,ASN,H2,0.3300000
charmm,n,ASN,H3,0.3300000
charmm,n,ASN,CA,0.2100000
charmm,n,ASN,HA,0.1000000
charmm,n,ASN,CB,-0.1800000
charmm,n,ASN,HB2,0.0900000
charmm,n,ASN,HB3,0.0900000
charmm,n,ASN,CG,0.5500000
charmm,n,ASN,OD1,-0.5500000
charmm,n,ASN,ND2,-0.6200000
charmm,n,ASN,HD21,0.3200000
charmm,n,ASN,HD22,0.3000000
charmm,n,ASN,C,0.5100000
charmm,n,ASN,O,-0.5100000
charmm,c,ASN,N,-0.4700000
charmm,c,ASN,H,0.3100000
charmm,c,ASN,CA,0.0700000
charmm,c,ASN,HA,0.0900000
charmm,c,ASN,CB,-0.1800000
charmm,c,ASN,HB2,0.0900000
charmm,c,ASN,HB3,0.0900000
charmm,c,ASN,CG,0.5500000
charmm,c,ASN,OD1,-0.5500000
charmm,c,ASN,ND2,-0.6200000
charmm,c,ASN,HD21,0.3200000
charmm,c,ASN,HD22,0.3000000
charmm,c,ASN,C,0.3400000
charmm,c,ASN,O,-0.6700000
charmm,c,ASN,OXT,-0.6700000
charmm,n-,ASN,N,-0.9600000
charmm,n-,ASN,H1,0.3400000
charmm,n-,ASN,H2,0.3400000
charmm,n-,ASN,CA,0.1900000
charmm,n-,ASN,HA,0.0900000
charmm,n-,ASN,CB,-0.1800000
charmm,n-,ASN,HB2,0.0900000
charmm,n-,ASN,HB3,0.0900000
charmm,n-,ASN,CG,0.5500000
charmm,n-,ASN,OD1,-0.5500000
charmm,n-,ASN,ND2,-0.6200000
charmm,n-,ASN,HD21,0.3200000
charmm,n-,ASN,HD22,0.3000000
charmm,n-,ASN,C,0.5100000
charmm,n-,ASN,O,-0.5100000
charmm,c+,ASN,N,-0.4700000
charmm,c+,ASN,H,0.3100000
charmm,c+,ASN,CA,0.0700000
charmm,c+,ASN,HA,0.0900000
charmm,c+,ASN,CB,-0.1800000
charmm,c+,ASN,HB2,0.0900000
charmm,c+,ASN,HB3,0.0900000
charmm,c+,ASN,CG,0.5500000
charmm,c+,ASN,OD1,-0.5500000
charmm,c+,ASN,ND2,-0.6200000
charmm,c+,ASN,HD21,0.3200000
charmm,c+,ASN,HD22,0.3000000
charmm,c+,ASN,C,0.7200000
charmm,c+,ASN,O,-0.5500000
charmm,c+,ASN,OXT,-0.6100000
charmm,c+,ASN,HOXT,0.4400000
charmm,m,ASP,N,-0.4700000
charmm,m,ASP,H,0.3100000
charmm,m,ASP,CA,0.0700000
charmm,m,ASP,HA,0.0900000
charmm,m,ASP,CB,-0.2800000
charmm,m,ASP,HB2,0.0900000
charmm,m,ASP,HB3,0.0900000
charmm,m,ASP,CG,0.6200000
charmm,m,ASP,OD1,-0.7600000
charmm,m,ASP,OD2,-0.7600000
charmm,m,ASP,C,0.5100000
charmm,m,ASP,O,-0.5100000
charmm,n,ASP,N,-0.3000000
charmm,n,ASP,H1,0.3300000
charmm,n,ASP,H2,0.3300000
charmm,n,ASP,H3,0.3300000
charmm,n,ASP,CA,0.2100000
charmm,n,ASP,HA,0.1000000
charmm,n,ASP,CB,-0.2800000
charmm,n,ASP,HB2,0.0900000
charmm,n,ASP,HB3,0.0900000
charmm,n,ASP,CG,0.6200000
charmm,n,ASP,OD1,-0.7600000
charmm,n,ASP,OD2,-0.7600000
charmm,n,ASP,C,0.5100000
charmm,n,ASP,O,-0.5100000
charmm,c,ASP,N,-0.4700000
charmm,c,ASP,H,0.3100000
charmm,c,ASP,CA,0.0700000
charmm,c,ASP,HA,0.0900000
charmm,c,ASP,CB,-0.2800000
charmm,c,ASP,HB2,0.0900000
charmm,c,ASP,HB3,0.0900000
charmm,c,ASP,CG,0.6200000
charmm,c,ASP,OD1,-0.7600000
charmm,c,ASP,OD2,-0.7600000
charmm,c,ASP,C,0.3400000
charmm,c,ASP,O,-0.6700000
charmm,c,ASP,OXT,-0.6700000
charmm,n-,ASP,N,-0.9600000
charmm,n-,ASP,H1,0.3400000
charmm,n-,ASP,H2,0.3400000
charmm,n-,ASP,CA,0.1900000
charmm,n-,ASP,HA,0.0900000
charmm,n-,ASP,CB,-0.2800000
charmm,n-,ASP,HB2,0.0900000
charmm,n-,ASP,HB3,0.0900000
charmm,n-,ASP,CG,0.6200000
charmm,n-,ASP,OD1,-0.7600000
charmm,n-,ASP,OD2,-0.7600000
charmm,n-,ASP,C,0.5100000
charmm,n-,ASP,O,-0.5100000
charmm,c+,ASP,N,-0.4700000
charmm,c+,ASP,H,0.3100000
charmm,c+,ASP,CA,0.0700000
charmm,c+,ASP,HA,0.0900000
charmm,c+,ASP,CB,-0.2800000
charmm,c+,ASP,HB2,0.0900000
charmm,c+,ASP,HB3,0.0900000
charmm,c+,ASP,CG,0.6200000
charmm,c+,ASP,OD1,-0.7600000
charmm,c+,ASP,OD2,-0.7600000
charmm,c+,ASP,C,0.7200000
charmm,c+,ASP,O,-0.5500000
charmm,c+,ASP,OXT,-0.6100000
charmm,c+,ASP,HOXT,0.4400000
charmm,m,ASH,N,-0.4700000
charmm,m,ASH,H,0.3100000
charmm,m,ASH,CA,0.0700000
charmm,m,ASH,HA,0.0900000
charmm,m,ASH,CB,-0.2100000
charmm,m,ASH,HB2,0.0900000
charmm,m,ASH,HB3,0.0900000
charmm,m,ASH,CG,0.7500000
charmm,m,ASH,OD1,-0.5500000
charmm,m,ASH,OD2,-0.6100000
charmm,m,ASH,HD2,0.4400000
charmm,m,ASH,C,0.5100000
charmm,m,ASH,O,-0.5100000
charmm,n,ASH,N,-0.3000000
charmm,n,ASH,H1,0.3300000
charmm,n,ASH,H2,0.3300000
charmm,n,ASH,H3,0.3300000
charmm,n,ASH,CA,0.2100000
charmm,n,ASH,HA,0.1000000
charmm,n,ASH,CB,-0.2100000
charmm,n,ASH,HB2,0.0900000
charmm,n,ASH,HB3,0.0900000
charmm,n,ASH,CG,0.7500000
charmm,n,ASH,OD1,-0.5500000
charmm,n,ASH,OD2,-0.6100000
charmm,n,ASH,HD2,0.4400000
charmm,n,ASH,C,0.5100000
charmm,n,ASH,O,-0.5100000
charmm,c,ASH,N,-0.4700000
charmm,c,ASH,H,0.3100000
charmm,c,ASH,CA,0.0700000
charmm,c,ASH,HA,0.0900000
charmm,c,ASH,CB,-0.2100000
charmm,c,ASH,HB2,0.0900000
charmm,c,ASH,HB3,0.0900000
charmm,c,ASH,CG,0.7500000
charmm,c,ASH,OD1,-0.5500000
charmm,c,ASH,OD2,-0.6100000
charmm,c,ASH,HD2,0.4400000
charmm,c,ASH,C,0.3400000
charmm,c,ASH,O,-0.6700000
charmm,c,ASH,OXT,-0.6700000
charmm,n-,ASH,N,-0.9600000
charmm,n-,ASH,H1,0.3400000
charmm,n-,ASH,H2,0.3400000
charmm,n-,ASH,CA,0.1900000
charmm,n-,ASH,HA,0.0900000
charmm,n-,ASH,CB,-0.2100000
charmm,n-,ASH,HB2,0.0900000
charmm,n-,ASH,HB3,0.0900000
charmm,n-,ASH,CG,0.7500000
charmm,n-,ASH,OD1,-0.5500000
charmm,n-,ASH,OD2,-0.6100000
charmm,n-,ASH,HD2,0.4400000
charmm,n-,ASH,C,0.5100000
charmm,n-,ASH,O,-0.5100000
charmm,c+,ASH,N,-0.4700000
charmm,c+,ASH,H,0.3100000
charmm,c+,ASH,CA,0.0700000
charmm,c+,ASH,HA,0.0900000
charmm,c+,ASH,CB,-0.2100000
charmm,c+,ASH,HB2,0.0900000
charmm,c+,ASH,HB3,0.0900000
charmm,c+,ASH,CG,0.7500000
charmm,c+,ASH,OD1,-0.5500000
charmm,c+,ASH,OD2,-0.6100000
charmm,c+,ASH,HD2,0.4400000
charmm,c+,ASH,C,0.7200000
charmm,c+,ASH,O,-0.5500000
charmm,c+,ASH,OXT,-0.6100000
charmm,c+,ASH,HOXT,0.4400000
charmm,m,CYS,N,-0.4700000
charmm,m,CYS,H,0.3100000
charmm,m,CYS,CA,0.0700000
charmm,m,CYS,HA,0.0900000
charmm,m,CYS,CB,-0.1100000
charmm,m,CYS,HB2,0.0900000
charmm,m,CYS,HB3,0.0900000
charmm,m,CYS,SG,-0.2300000
charmm,m,CYS,HG,0.1600000
charmm,m,CYS,C,0.5100000
charmm,m,CYS,O,-0.5100000
charmm,n,CYS,N,-0.3000000
charmm,n,CYS,H1,0.3300000
charmm,n,CYS,H2,0.3300000
charmm,n,CYS,H3,0.3300000
charmm,n,CYS,CA,0.2100000
charmm,n,CYS,HA,0.1000000
charmm,n,CYS,CB,-0.1100000
charmm,n,CYS,HB2,0.0900000
charmm,n,CYS,HB3,0.0900000
charmm,n,CYS,SG,-0.2300000
charmm,n,CYS,HG,0.1600000
charmm,n,CYS,C,0.5100000
charmm,n,CYS,O,-0.5100000
charmm,c,CYS,N,-0.4700000
charmm,c,CYS,H,0.3100000
charmm,c,CYS,CA,0.0700000
charmm,c,CYS,HA,0.0900000
charmm,c,CYS,CB,-0.1100000
charmm,c,CYS,HB2,0.0900000
charmm,c,CYS,HB3,0.0900000
charmm,c,CYS,SG,-0.2300000
charmm,c,CYS,HG,0.1600000
charmm,c,CYS,C,0.3400000
charmm,c,CYS,O,-0.6700000
charmm,c,CYS,OXT,-0.6700000
charmm,n-,CYS,N,-0.9600000
charmm,n-,CYS,H1,0.3400000
charmm,n-,CYS,H2,0.3400000
charmm,n-,CYS,CA,0.1900000
charmm,n-,CYS,HA,0.0900000
charmm,n-,CYS,CB,-0.1100000
charmm,n-,CYS,HB2,0.0900000
charmm,n-,CYS,HB3,0.0900000
charmm,n-,CYS,SG,-0.2300000
charmm,n-,CYS,HG,0.1600000
charmm,n-,CYS,C,0.5100000
charmm,n-,CYS,O,-0.5100000
charmm,c+,CYS,N,-0.4700000
charmm,c+,CYS,H,0.3100000
charmm,c+,CYS,CA,0.0700000
charmm,c+,CYS,HA,0.0900000
charmm,c+,CYS,CB,-0.1100000
charmm,c+,CYS,HB2,0.0900000
charmm,c+,CYS,HB3,0.0900000
charmm,c+,CYS,SG,-0.2300000
charmm,c+,CYS,HG,0.1600000
charmm,c+,CYS,C,0.7200000
charmm,c+,CYS,O,-0.5500000
charmm,c+,CYS,OXT,-0.6100000
charmm,c+,CYS,HOXT,0.4400000
charmm,m,CYM,N,-0.4700000
charmm,m,CYM,H,0.3100000
charmm,m,CYM,CA,0.0700000
charmm,m,CYM,HA,0.0900000
charmm,m,CYM,CB,-0.3800000
charmm,m,CYM,HB2,0.0900000
charmm,m,CYM,HB3,0.0900000
charmm,m,CYM,SG,-0.8000000
charmm,m,CYM,C,0.5100000
charmm,m,CYM,O,-0.5100000
charmm,n,CYM,N,-0.3000000
charmm,n,CYM,H1,0.3300000
charmm,n,CYM,H2,0.3300000
charmm,n,CYM,H3,0.3300000
charmm,n,CYM,CA,0.2100000
charmm,n,CYM,HA,0.1000000
charmm,n,CYM,CB,-0.3800000
charmm,n,CYM,HB2,0.0900000
charmm,n,CYM,HB3,0.0900000
charmm,n,CYM,SG,-0.8000000
charmm,n,CYM,C,0.5100000
charmm,n,CYM,O,-0.5100000
charmm,c,CYM,N,-0.4700000
charmm,c,CYM,H,0.3100000
charmm,c,CYM,CA,0.0700000
charmm,c,CYM,HA,0.0900000
charmm,c,CYM,CB,-0.3800000
charmm,c,CYM,HB2,0.0900000
charmm,c,CYM,HB3,0.0900000
charmm,c,CYM,SG,-0.8000000
charmm,c,CYM,C,0.3400000
charmm,c,CYM,O,-0.6700000
charmm,c,CYM,OXT,-0.6700000
charmm,n-,CYM,N,-0.9600000
charmm,n-,CYM,H1,0.3400000
charmm,n-,CYM,H2,0.3400000
charmm,n-,CYM,CA,0.1900000
charmm,n-,CYM,HA,0.0900000
charmm,n-,CYM,CB,-0.3800000
charmm,n-,CYM,HB2,0.0900000
charmm,n-,CYM,HB3,0.0900000
charmm,n-,CYM,SG,-0.8000000
charmm,n-,CYM,C,0.5100000
charmm,n-,CYM,O,-0.5100000
charmm,c+,CYM,N,-0.4700000
charmm,c+,CYM,H,0.3100000
charmm,c+,CYM,CA,0.0700000
charmm,c+,CYM,HA,0.0900000
charmm,c+,CYM,CB,-0.3800000
charmm,c+,CYM,HB2,0.0900000
charmm,c+,CYM,HB3,0.0900000
charmm,c+,CYM,SG,-0.8000000
charmm,c+,CYM,C,0.7200000
charmm,c+,CYM,O,-0.5500000
charmm,c+,CYM,OXT,-0.6100000
charmm,c+,CYM,HOXT,0.4400000
charmm,m,CYX,N,-0.4700000
charmm,m,CYX,H,0.3100000
charmm,m,CYX,CA,0.0700000
charmm,m,CYX,HA,0.0900000
charmm,m,CYX,CB,-0.1000000
charmm,m,CYX,HB2,0.0900000
charmm,m,CYX,HB3,0.0900000
charmm,m,CYX,SG,-0.0800000
charmm,m,CYX,C,0.5100000
charmm,m,CYX,O,-0.5100000
charmm,n,CYX,N,-0.3000000
charmm,n,CYX,H1,0.3300000
charmm,n,CYX,H2,0.3300000
charmm,n,CYX,H3,0.3300000
charmm,n,CYX,CA,0.2100000
charmm,n,CYX,HA,0.1000000
charmm,n,CYX,CB,-0.1000000
charmm,n,CYX,HB2,0.0900000
charmm,n,CYX,HB3,0.0900000
charmm,n,CYX,SG,-0.0800000
charmm,n,CYX,C,0.5100000
charmm,n,CYX,O,-0.5100000
charmm,c,CYX,N,-0.4700000
charmm,c,CYX,H,0.3100000
charmm,c,CYX,CA,0.0700000
charmm,c,CYX,HA,0.0900000
charmm,c,CYX,CB,-0.1000000
charmm,c,CYX,HB2,0.0900000
charmm,c,CYX,HB3,0.0900000
charmm,c,CYX,SG,-0.0800000
charmm,c,CYX,C,0.3400000
charmm,c,CYX,O,-0.6700000
charmm,c,CYX,OXT,-0.6700000
charmm,n-,CYX,N,-0.9600000
charmm,n-,CYX,H1,0.3400000
charmm,n-,CYX,H2,0.3400000
charmm,n-,CYX,CA,0.1900000
charmm,n-,CYX,HA,0.0900000
charmm,n-,CYX,CB,-0.1000000
charmm,n-,CYX,HB2,0.0900000
charmm,n-,CYX,HB3,0.0900000
charmm,n-,CYX,SG,-0.0800000
charmm,n-,CYX,C,0.5100000
charmm,n-,CYX,O,-0.5100000
charmm,c+,CYX,N,-0.4700000
charmm,c+,CYX,H,0.3100000
charmm,c+,CYX,CA,0.0700000
charmm,c+,CYX,HA,0.0900000
charmm,c+,CYX,CB,-0.1000000
charmm,c+,CYX,HB2,0.0900000
charmm,c+,CYX,HB3,0.0900000
charmm,c+,CYX,SG,-0.0800000
charmm,c+,CYX,C,0.7200000
charmm,c+,CYX,O,-0.5500000
charmm,c+,CYX,OXT,-0.6100000
charmm,c+,CYX,HOXT,0.4400000
charmm,m,GLN,N,-0.4700000
charmm,m,GLN,H,0.3100000
charmm,m,GLN,CA,0.0700000
charmm,m,GLN,HA,0.0900000
charmm,m,GLN,CB,-0.1800000
charmm,m,GLN,HB2,0.0900000
charmm,m,GLN,HB3,0.0900000
charmm,m,GLN,CG,-0.1800000
charmm,m,GLN,HG2,0.0900000
charmm,m,GLN,HG3,0.0900000
charmm,m,GLN,CD,0.5500000
charmm,m,GLN,OE1,-0.5500000
charmm,m,GLN,NE2,-0.6200000
charmm,m,GLN,HE21,0.3200000
charmm,m,GLN,HE22,0.3000000
charmm,m,GLN,C,0.5100000
charmm,m,GLN,O,-0.5100000
charmm,n,GLN,N,-0.3000000
charmm,n,GLN,H1,0.3300000
charmm,n,GLN,H2,0.3300000
charmm,n,GLN,H3,0.3300000
charmm,n,GLN,CA,0.2100000
charmm,n,GLN,HA,0.1000000
charmm,n,GLN,CB,-0.1800000
charmm,n,GLN,HB2,0.0900000
charmm,n,GLN,HB3,0.0900000
charmm,n,GLN,CG,-0.1800000
charmm,n,GLN,HG2,0.0900000
charmm,n,GLN,HG3,0.0900000
charmm,n,GLN,CD,0.5500000
charmm,n,GLN,OE1,-0.5500000
charmm,n,GLN,NE2,-0.6200000
charmm,n,GLN,HE21,0.3200000
charmm,n,GLN,HE22,0.3000000
charmm,n,GLN,C,0.5100000
charmm,n,GLN,O,-0.5100000
charmm,c,GLN,N,-0.4700000
charmm,c,GLN,H,0.3100000
charmm,c,GLN,CA,0.0700000
charmm,c,GLN,HA,0.0900000
charmm,c,GLN,CB,-0.1800000
charmm,c,GLN,HB2,0.0900000
charmm,c,GLN,HB3,0.0900000
charmm,c,GLN,CG,-0.1800000
charmm,c,GLN,HG2,0.0900000
charmm,c,GLN,HG3,0.0900000
charmm,c,GLN,CD,0.5500000
charmm,c,GLN,OE1,-0.5500000
charmm,c,GLN,NE2,-0.6200000
charmm,c,GLN,HE21,0.3200000
charmm,c,GLN,HE22,0.3000000
charmm,c,GLN,C,0.3400000
charmm,c,GLN,O,-0.6700000
charmm,c,GLN,OXT,-0.6700000
charmm,n-,GLN,N,-0.9600000
charmm,n-,GLN,H1,0.3400000
charmm,n-,GLN,H2,0.3400000
charmm,n-,GLN,CA,0.1900000
charmm,n-,GLN,HA,0.0900000
charmm,n-,GLN,CB,-0.1800000
charmm,n-,GLN,HB2,0.0900000
charmm,n-,GLN,HB3,0.0900000
charmm,n-,GLN,CG,-0.1800000
charmm,n-,GLN,HG2,0.0900000
charmm,n-,GLN,HG3,0.0900000
charmm,n-,GLN,CD,0.5500000
charmm,n-,GLN,OE1,-0.5500000
charmm,n-,GLN,NE2,-0.6200000
charmm,n-,GLN,HE21,0.3200000
charmm,n-,GLN,HE22,0.3000000
charmm,n-,GLN,C,0.5100000
charmm,n-,GLN,O,-0.5100000
charmm,c+,GLN,N,-0.4700000
charmm,c+,GLN,H,0.3100000
charmm,c+,GLN,CA,0.0700000
charmm,c+,GLN,HA,0.0900000
charmm,c+,GLN,CB,-0.1800000
charmm,c+,GLN,HB2,0.0900000
charmm,c+,GLN,HB3,0.0900000
charmm,c+,GLN,CG,-0.1800000
charmm,c+,GLN,HG2,0.0900000
charmm,c+,GLN,HG3,0.0900000
charmm,c+,GLN,CD,0.5500000
charmm,c+,GLN,OE1,-0.5500000
charmm,c+,GLN,NE2,-0.6200000
charmm,c+,GLN,HE21,0.3200000
charmm,c+,GLN,HE22,0.3000000
charmm,c+,GLN,C,0.7200000
charmm,c+,GLN,O,-0.5500000
charmm,c+,GLN,OXT,-0.6100000
charmm,c+,GLN,HOXT,0.4400000
charmm,m,GLU,N,-0.4700000
charmm,m,GLU,H,0.3100000
charmm,m,GLU,CA,0.0700000
charmm,m,GLU,HA,0.0900000
charmm,m,GLU,CB,-0.1800000
charmm,m,GLU,HB2,0.0900000
charmm,m,GLU,HB3,0.0900000
charmm,m,GLU,CG,-0.2800000
charmm,m,GLU,HG2,0.0900000
charmm,m,GLU,HG3,0.0900000
charmm,m,GLU,CD,0.6200000
charmm,m,GLU,OE1,-0.7600000
charmm,m,GLU,OE2,-0.7600000
charmm,m,GLU,C,0.5100000
charmm,m,GLU,O,-0.5100000
charmm,n,GLU,N,-0.3000000
charmm,n,GLU,H1,0.3300000
charmm,n,GLU,H2,0.3300000
charmm,n,GLU,H3,0.3300000
charmm,n,GLU,CA,0.2100000
charmm,n,GLU,HA,0.1000000
charmm,n,GLU,CB,-0.1800000
charmm,n,GLU,HB2,0.0900000
charmm,n,GLU,HB3,0.0900000
charmm,n,GLU,CG,-0.2800000
charmm,n,GLU,HG2,0.0900000
charmm,n,GLU,HG3,0.0900000
charmm,n,GLU,CD,0.6200000
charmm,n,GLU,OE1,-0.7600000
charmm,n,GLU,OE2,-0.7600000
charmm,n,GLU,C,0.5100000
charmm,n,GLU,O,-0.5100000
charmm,c,GLU,N,-0.4700000
charmm,c,GLU,H,0.3100000
charmm,c,GLU,CA,0.0700000
charmm,c,GLU,HA,0.0900000
charmm,c,GLU,CB,-0.1800000
charmm,c,GLU,HB2,0.0900000
charmm,c,GLU,HB3,0.0900000
charmm,c,GLU,CG,-0.2800000
charmm,c,GLU,HG2,0.0900000
charmm,c,GLU,HG3,0.0900000
charmm,c,GLU,CD,0.6200000
charmm,c,GLU,OE1,-0.7600000
charmm,c,GLU,OE2,-0.7600000
charmm,c,GLU,C,0.3400000
charmm,c,GLU,O,-0.6700000
charmm,c,GLU,OXT,-0.6700000
charmm,n-,GLU,N,-0.9600000
charmm,n-,GLU,H1,0.3400000
charmm,n-,GLU,H2,0.3400000
charmm,n-,GLU,CA,0.1900000
charmm,n-,GLU,HA,0.0900000
charmm,n-,GLU,CB,-0.1800000
charmm,n-,GLU,HB2,0.0900000
charmm,n-,GLU,HB3,0.0900000
charmm,n-,GLU,CG,-0.2800000
charmm,n-,GLU,HG2,0.0900000
charmm,n-,GLU,HG3,0.0900000
charmm,n-,GLU,CD,0.6200000
charmm,n-,GLU,OE1,-0.7600000
charmm,n-,GLU,OE2,-0.7600000
charmm,n-,GLU,C,0.5100000
charmm,n-,GLU,O,-0.5100000
charmm,c+,GLU,N,-0.4700000
charmm,c+,GLU,H,0.3100000
charmm,c+,GLU,CA,0.0700000
charmm,c+,GLU,HA,0.0900000
charmm,c+,GLU,CB,-0.1800000
charmm,c+,GLU,HB2,0.0900000
charmm,c+,GLU,HB3,0.0900000
charmm,c+,GLU,CG,-0.2800000
charmm,c+,GLU,HG2,0.0900000
charmm,c+,GLU,HG3,0.0900000
charmm,c+,GLU,CD,0.6200000
charmm,c+,GLU,OE1,-0.7600000
charmm,c+,GLU,OE2,-0.7600000
charmm,c+,GLU,C,0.7200000
charmm,c+,GLU,O,-0.5500000
charmm,c+,GLU,OXT,-0.6100000
charmm,c+,GLU,HOXT,0.4400000
charmm,m,GLH,N,-0.4700000
charmm,m,GLH,H,0.3100000
charmm,m,GLH,CA,0.0700000
charmm,m,GLH,HA,0.0900000
charmm,m,GLH,CB,-0.1800000
charmm,m,GLH,HB2,0.0900000
charmm,m,GLH,HB3,0.0900000
charmm,m,GLH,CG,-0.2100000
charmm,m,GLH,HG2,0.0900000
charmm,m,GLH,HG3,0.0900000
charmm,m,GLH,CD,0.7500000
charmm,m,GLH,OE1,-0.5500000
charmm,m,GLH,OE2,-0.6100000
charmm,m,GLH,HE2,0.4400000
charmm,m,GLH,C,0.5100000
charmm,m,GLH,O,-0.5100000
charmm,n,GLH,N,-0.3000000
charmm,n,GLH,H1,0.3300000
charmm,n,GLH,H2,0.3300000
charmm,n,GLH,H3,0.3300000
charmm,n,GLH,CA,0.2100000
charmm,n,GLH,HA,0.1000000
charmm,n,GLH,CB,-0.1800000
charmm,n,GLH,HB2,0.0900000
charmm,n,GLH,HB3,0.0900000
charmm,n,GLH,CG,-0.2100000
charmm,n,GLH,HG2,0.0900000
charmm,n,GLH,HG3,0.0900000
charmm,n,GLH,CD,0.7500000
charmm,n,GLH,OE1,-0.5500000
charmm,n,GLH,OE2,-0.6100000
charmm,n,GLH,HE2,0.4400000
charmm,n,GLH,C,0.5100000
charmm,n,GLH,O,-0.5100000
charmm,c,GLH,N,-0.4700000
charmm,c,GLH,H,0.3100000
charmm,c,GLH,CA,0.0700000
charmm,c,GLH,HA,0.0900000
charmm,c,GLH,CB,-0.1800000
charmm,c,GLH,HB2,0.0900000
charmm,c,GLH,HB3,0.0900000
charmm,c,GLH,CG,-0.2100000
charmm,c,GLH,HG2,0.0900000
charmm,c,GLH,HG3,0.0900000
charmm,c,GLH,CD,0.7500000
charmm,c,GLH,OE1,-0.5500000
charmm,c,GLH,OE2,-0.6100000
charmm,c,GLH,HE2,0.4400000
charmm,c,GLH,C,0.3400000
charmm,c,GLH,O,-0.6700000
charmm,c,GLH,OXT,-0.6700000
charmm,n-,GLH,N,-0.9600000
charmm,n-,GLH,H1,0.3400000
charmm,n-,GLH,H2,0.3400000
charmm,n-,GLH,CA,0.1900000
charmm,n-,GLH,HA,0.0900000
charmm,n-,GLH,CB,-0.1800000
charmm,n-,GLH,HB2,0.0900000
charmm,n-,GLH,HB3,0.0900000
charmm,n-,GLH,CG,-0.2100000
charmm,n-,GLH,HG2,0.0900000
charmm,n-,GLH,HG3,0.0900000
charmm,n-,GLH,CD,0.7500000
charmm,n-,GLH,OE1,-0.5500000
charmm,n-,GLH,OE2,-0.6100000
charmm,n-,GLH,HE2,0.4400000
charmm,n-,GLH,C,0.5100000
charmm,n-,GLH,O,-0.5100000
charmm,c+,GLH,N,-0.4700000
charmm,c+,GLH,H,0.3100000
charmm,c+,GLH,CA,0.0700000
charmm,c+,GLH,HA,0.0900000
charmm,c+,GLH,CB,-0.1800000
charmm,c+,GLH,HB2,0.0900000
charmm,c+,GLH,HB3,0.0900000
charmm,c+,GLH,CG,-0.2100000
charmm,c+,GLH,HG2,0.0900000
charmm,c+,GLH,HG3,0.0900000
charmm,c+,GLH,CD,0.7500000
charmm,c+,GLH,OE1,-0.5500000
charmm,c+,GLH,OE2,-0.6100000
charmm,c+,GLH,HE2,0.4400000
charmm,c+,GLH,C,0.7200000
charmm,c+,GLH,O,-0.5500000
charmm,c+,GLH,OXT,-0.6100000
charmm,c+,GLH,HOXT,0.4400000
charmm,m,GLY,N,-0.4700000
charmm,m,GLY,H,0.3100000
charmm,m,GLY,CA,-0.0200000
charmm,m,GLY,HA2,0.0900000
charmm,m,GLY,HA3,0.0900000
charmm,m,GLY,C,0.5100000
charmm,m,GLY,O,-0.5100000
charmm,n,GLY,N,-0.3000000
charmm,n,GLY,H1,0.3300000
charmm,n,GLY,H2,0.3300000
charmm,n,GLY,H3,0.3300000
charmm,n,GLY,CA,0.1300000
charmm,n,GLY,HA2,0.0900000
charmm,n,GLY,HA3,0.0900000
charmm,n,GLY,C,0.5100000
charmm,n,GLY,O,-0.5100000
charmm,c,GLY,N,-0.4700000
charmm,c,GLY,H,0.3100000
charmm,c,GLY,CA,-0.0200000
charmm,c,GLY,HA2,0.0900000
charmm,c,GLY,HA3,0.0900000
charmm,c,GLY,C,0.3400000
charmm,c,GLY,O,-0.6700000
charmm,c,GLY,OXT,-0.6700000
charmm,n-,GLY,N,-0.9600000
charmm,n-,GLY,H1,0.3400000
charmm,n-,GLY,H2,0.3400000
charmm,n-,GLY,CA,0.1000000
charmm,n-,GLY,HA2,0.0900000
charmm,n-,GLY,HA3,0.0900000
charmm,n-,GLY,C,0.5100000
charmm,n-,GLY,O,-0.5100000
charmm,c+,GLY,N,-0.4700000
charmm,c+,GLY,H,0.3100000
charmm,c+,GLY,CA,-0.0200000
charmm,c+,GLY,HA2,0.0900000
charmm,c+,GLY,HA3,0.0900000
charmm,c+,GLY,C,0.7200000
charmm,c+,GLY,O,-0.5500000
charmm,c+,GLY,OXT,-0.6100000
charmm,c+,GLY,HOXT,0.4400000
charmm,m,HID,N,-0.4700000
charmm,m,HID,H,0.3100000
charmm,m,HID,CA,0.0700000
charmm,m,HID,HA,0.0900000
charmm,m,HID,CB,-0.0900000
charmm,m,HID,HB2,0.0900000
charmm,m,HID,HB3,0.0900000
charmm,m,HID,ND1,-0.3600000
charmm,m,HID,HD1,0.3200000
charmm,m,HID,CG,-0.0500000
charmm,m,HID,CE1,0.2500000
charmm,m,HID,HE1,0.1300000
charmm,m,HID,NE2,-0.7000000
charmm,m,HID,CD2,0.2200000
charmm,m,HID,HD2,0.1000000
charmm,m,HID,C,0.5100000
charmm,m,HID,O,-0.5100000
charmm,n,HID,N,-0.3000000
charmm,n,HID,H1,0.3300000
charmm,n,HID,H2,0.3300000
charmm,n,HID,H3,0.3300000
charmm,n,HID,CA,0.2100000
charmm,n,HID,HA,0.1000000
charmm,n,HID,CB,-0.0900000
charmm,n,HID,HB2,0.0900000
charmm,n,HID,HB3,0.0900000
charmm,n,HID,ND1,-0.3600000
charmm,n,HID,HD1,0.3200000
charmm,n,HID,CG,-0.0500000
charmm,n,HID,CE1,0.2500000
charmm,n,HID,HE1,0.1300000
charmm,n,HID,NE2,-0.7000000
charmm,n,HID,CD2,0.2200000
charmm,n,HID,HD2,0.1000000
charmm,n,HID,C,0.5100000
charmm,n,HID,O,-0.5100000
charmm,c,HID,N,-0.4700000
charmm,c,HID,H,0.3100000
charmm,c,HID,CA,0.0700000
charmm,c,HID,HA,0.0900000
charmm,c,HID,CB,-0.0900000
charmm,c,HID,HB2,0.0900000
charmm,c,HID,HB3,0.0900000
charmm,c,HID,ND1,-0.3600000
charmm,c,HID,HD1,0.3200000
charmm,c,HID,CG,-0.0500000
charmm,c,HID,CE1,0.2500000
charmm,c,HID,HE1,0.1300000
charmm,c,HID,NE2,-0.7000000
charmm,c,HID,CD2,0.2200000
charmm,c,HID,HD2,0.1000000
charmm,c,HID,C,0.3400000
charmm,c,HID,O,-0.6700000
charmm,c,HID,OXT,-0.6700000
charmm,n-,HID,N,-0.9600000
charmm,n-,HID,H1,0.3400000
charmm,n-,HID,H2,0.3400000
charmm,n-,HID,CA,0.1900000
charmm,n-,HID,HA,0.0900000
charmm,n-,HID,CB,-0.0900000
charmm,n-,HID,HB2,0.0900000
charmm,n-,HID,HB3,0.0900000
charmm,n-,HID,ND1,-0.3600000
charmm,n-,HID,HD1,0.3200000
charmm,n-,HID,CG,-0.0500000
charmm,n-,HID,CE1,0.2500000
charmm,n-,HID,HE1,0.1300000
charmm,n-,HID,NE2,-0.7000000
charmm,n-,HID,CD2,0.2200000
charmm,n-,HID,HD2,0.1000000
charmm,n-,HID,C,0.5100000
charmm,n-,HID,O,-0.5100000
charmm,c+,HID,N,-0.4700000
charmm,c+,HID,H,0.3100000
charmm,c+,HID,CA,0.0700000
charmm,c+,HID,HA,0.0900000
charmm,c+,HID,CB,-0.0900000
charmm,c+,HID,HB2,0.0900000
charmm,c+,HID,HB3,0.0900000
charmm,c+,HID,ND1,-0.3600000
charmm,c+,HID,HD1,0.3200000
charmm,c+,HID,CG,-0.0500000
charmm,c+,HID,CE1,0.2500000
charmm,c+,HID,HE1,0.1300000
charmm,c+,HID,NE2,-0.7000000
charmm,c+,HID,CD2,0.2200000
charmm,c+,HID,HD2,0.1000000
charmm,c+,HID,C,0.7200000
charmm,c+,HID,O,-0.5500000
charmm,c+,HID,OXT,-0.6100000
charmm,c+,HID,HOXT,0.4400000
charmm,m,HIE,N,-0.4700000
charmm,m,HIE,H,0.3100000
charmm,m,HIE,CA,0.0700000
charmm,m,HIE,HA,0.0900000
charmm,m,HIE,CB,-0.0800000
charmm,m,HIE,HB2,0.0900000
charmm,m,HIE,HB3,0.0900000
charmm,m,HIE,ND1,-0.7000000
charmm,m,HIE,CG,0.2200000
charmm,m,HIE,CE1,0.2500000
charmm,m,HIE,HE1,0.1300000
charmm,m,HIE,NE2,-0.3600000
charmm,m,HIE,HE2,0.3200000
charmm,m,HIE,CD2,-0.0500000
charmm,m,HIE,HD2,0.0900000
charmm,m,HIE,C,0.5100000
charmm,m,HIE,O,-0.5100000
charmm,n,HIE,N,-0.3000000
charmm,n,HIE,H1,0.3300000
charmm,n,HIE,H2,0.3300000
charmm,n,HIE,H3,0.3300000
charmm,n,HIE,CA,0.2100000
charmm,n,HIE,HA,0.1000000
charmm,n,HIE,CB,-0.0800000
charmm,n,HIE,HB2,0.0900000
charmm,n,HIE,HB3,0.0900000
charmm,n,HIE,ND1,-0.7000000
charmm,n,HIE,CG,0.2200000
charmm,n,HIE,CE1,0.2500000
charmm,n,HIE,HE1,0.1300000
charmm,n,HIE,NE2,-0.3600000
charmm,n,HIE,HE2,0.3200000
charmm,n,HIE,CD2,-0.0500000
charmm,n,HIE,HD2,0.0900000
charmm,n,HIE,C,0.5100000
charmm,n,HIE,O,-0.5100000
charmm,c,HIE,N,-0.4700000
charmm,c,HIE,H,0.3100000
charmm,c,HIE,CA,0.0700000
charmm,c,HIE,HA,0.0900000
charmm,c,HIE,CB,-0.0800000
charmm,c,HIE,HB2,0.0900000
charmm,c,HIE,HB3,0.0900000
charmm,c,HIE,ND1,-0.7000000
charmm,c,HIE,CG,0.2200000
charmm,c,HIE,CE1,0.2500000
charmm,c,HIE,HE1,0.1300000
charmm,c,HIE,NE2,-0.3600000
charmm,c,HIE,HE2,0.3200000
charmm,c,HIE,CD2,-0.0500000
charmm,c,HIE,HD2,0.0900000
charmm,c,HIE,C,0.3400000
charmm,c,HIE,O,-0.6700000
charmm,c,HIE,OXT,-0.6700000
charmm,n-,HIE,N,-0.9600000
charmm,n-,HIE,H1,0.3400000
charmm,n-,HIE,H2,0.3400000
charmm,n-,HIE,CA,0.1900000
charmm,n-,HIE,HA,0.0900000
charmm,n-,HIE,CB,-0.0800000
charmm,n-,HIE,HB2,0.0900000
charmm,n-,HIE,HB3,0.0900000
charmm,n-,HIE,ND1,-0.7000000
charmm,n-,HIE,CG,0.2200000
charmm,n-,HIE,CE1,0.2500000
charmm,n-,HIE,HE1,0.1300000
charmm,n-,HIE,NE2,-0.3600000
charmm,n-,HIE,HE2,0.3200000
charmm,n-,HIE,CD2,-0.0500000
charmm,n-,HIE,HD2,0.0900000
charmm,n-,HIE,C,0.5100000
charmm,n-,HIE,O,-0.5100000
charmm,c+,HIE,N,-0.4700000
charmm,c+,HIE,H,0.3100000
charmm,c+,HIE,CA,0.0700000
charmm,c+,HIE,HA,0.0900000
charmm,c+,HIE,CB,-0.0800000
charmm,c+,HIE,HB2,0.0900000
charmm,c+,HIE,HB3,0.0900000
charmm,c+,HIE,ND1,-0.7000000
charmm,c+,HIE,CG,0.2200000
charmm,c+,HIE,CE1,0.2500000
charmm,c+,HIE,HE1,0.1300000
charmm,c+,HIE,NE2,-0.3600000
charmm,c+,HIE,HE2,0.3200000
charmm,c+,HIE,CD2,-0.0500000
charmm,c+,HIE,HD2,0.0900000
charmm,c+,HIE,C,0.7200000
charmm,c+,HIE,O,-0.5500000
charmm,c+,HIE,OXT,-0.6100000
charmm,c+,HIE,HOXT,0.4400000
charmm,m,HIP,N,-0.4700000
charmm,m,HIP,H,0.3100000
charmm,m,HIP,CA,0.0700000
charmm,m,HIP,HA,0.0900000
charmm,m,HIP,CB,-0.0500000
charmm,m,HIP,HB2,0.0900000
charmm,m,HIP,HB3,0.0900000
charmm,m,HIP,CG,0.1900000
charmm,m,HIP,ND1,-0.5100000
charmm,m,HIP,HD1,0.4400000
charmm,m,HIP,CD2,0.1900000
charmm,m,HIP,HD2,0.1300000
charmm,m,HIP,CE1,0.3200000
charmm,m,HIP,HE1,0.1800000
charmm,m,HIP,NE2,-0.5100000
charmm,m,HIP,HE2,0.4400000
charmm,m,HIP,C,0.5100000
charmm,m,HIP,O,-0.5100000
charmm,n,HIP,N,-0.3000000
charmm,n,HIP,H1,0.3300000
charmm,n,HIP,H2,0.3300000
charmm,n,HIP,H3,0.3300000
charmm,n,HIP,CA,0.2100000
charmm,n,HIP,HA,0.1000000
charmm,n,HIP,CB,-0.0500000
charmm,n,HIP,HB2,0.0900000
charmm,n,HIP,HB3,0.0900000
charmm,n,HIP,CG,0.1900000
charmm,n,HIP,ND1,-0.5100000
charmm,n,HIP,HD1,0.4400000
charmm,n,HIP,CD2,0.1900000
charmm,n,HIP,HD2,0.1300000
charmm,n,HIP,CE1,0.3200000
charmm,n,HIP,HE1,0.1800000
charmm,n,HIP,NE2,-0.5100000
charmm,n,HIP,HE2,0.4400000
charmm,n,HIP,C,0.5100000
charmm,n,HIP,O,-0.5100000
charmm,c,HIP,N,-0.4700000
charmm,c,HIP,H,0.3100000
charmm,c,HIP,CA,0.0700000
charmm,c,HIP,HA,0.0900000
charmm,c,HIP,CB,-0.0500000
charmm,c,HIP,HB2,0.0900000
charmm,c,HIP,HB3,0.0900000
charmm,c,HIP,CG,0.1900000
charmm,c,HIP,ND1,-0.5100000
charmm,c,HIP,HD1,0.4400000
charmm,c,HIP,CD2,0.1900000
charmm,c,HIP,HD2,0.1300000
charmm,c,HIP,CE1,0.3200000
charmm,c,HIP,HE1,0.1800000
charmm,c,HIP,NE2,-0.5100000
charmm,c,HIP,HE2,0.4400000
charmm,c,HIP,C,0.3400000
charmm,c,HIP,O,-0.6700000
charmm,c,HIP,OXT,-0.6700000
charmm,n-,HIP,N,-0.9600000
charmm,n-,HIP,H1,0.3400000
charmm,n-,HIP,H2,0.3400000
charmm,n-,HIP,CA,0.1900000
charmm,n-,HIP,HA,0.0900000
charmm,n-,HIP,CB,-0.0500000
charmm,n-,HIP,HB2,0.0900000
charmm,n-,HIP,HB3,0.0900000
charmm,n-,HIP,CG,0.1900000
charmm,n-,HIP,ND1,-0.5100000
charmm,n-,HIP,HD1,0.4400000
charmm,n-,HIP,CD2,0.1900000
charmm,n-,HIP,HD2,0.1300000
charmm,n-,HIP,CE1,0.3200000
charmm,n-,HIP,HE1,0.1800000
charmm,n-,HIP,NE2,-0.5100000
charmm,n-,HIP,HE2,0.4400000
charmm,n-,HIP,C,0.5100000
charmm,n-,HIP,O,-0.5100000
charmm,c+,HIP,N,-0.4700000
charmm,c+,HIP,H,0.3100000
charmm,c+,HIP,CA,0.0700000
charmm,c+,HIP,HA,0.0900000
charmm,c+,HIP,CB,-0.0500000
charmm,c+,HIP,HB2,0.0900000
charmm,c+,HIP,HB3,0.0900000
charmm,c+,HIP,CG,0.1900000
charmm,c+,HIP,ND1,-0.5100000
charmm,c+,HIP,HD1,0.4400000
charmm,c+,HIP,CD2,0.1900000
charmm,c+,HIP,HD2,0.1300000
charmm,c+,HIP,CE1,0.3200000
charmm,c+,HIP,HE1,0.1800000
charmm,c+,HIP,NE2,-0.5100000
charmm,c+,HIP,HE2,0.4400000
charmm,c+,HIP,C,0.7200000
charmm,c+,HIP,O,-0.5500000
charmm,c+,HIP,OXT,-0.6100000
charmm,c+,HIP,HOXT,0.4400000
charmm,m,ILE,N,-0.4700000
charmm,m,ILE,H,0.3100000
charmm,m,ILE,CA,0.0700000
charmm,m,ILE,HA,0.0900000
charmm,m,ILE,CB,-0.0900000
charmm,m,ILE,HB,0.0900000
charmm,m,ILE,CG2,-0.2700000
charmm,m,ILE,HG21,0.0900000
charmm,m,ILE,HG22,0.0900000
charmm,m,ILE,HG23,0.0900000
charmm,m,ILE,CG1,-0.1800000
charmm,m,ILE,HG12,0.0900000
charmm,m,ILE,HG13,0.0900000
charmm,m,ILE,CD1,-0.2700000
charmm,m,ILE,HD11,0.0900000
charmm,m,ILE,HD12,0.0900000
charmm,m,ILE,HD13,0.0900000
charmm,m,ILE,C,0.5100000
charmm,m,ILE,O,-0.5100000
charmm,n,ILE,N,-0.3000000
charmm,n,ILE,H1,0.3300000
charmm,n,ILE,H2,0.3300000
charmm,n,ILE,H3,0.3300000
charmm,n,ILE,CA,0.2100000
charmm,n,ILE,HA,0.1000000
charmm,n,ILE,CB,-0.0900000
charmm,n,ILE,HB,0.0900000
charmm,n,ILE,CG2,-0.2700000
charmm,n,ILE,HG21,0.0900000
charmm,n,ILE,HG22,0.0900000
charmm,n,ILE,HG23,0.0900000
charmm,n,ILE,CG1,-0.1800000
charmm,n,ILE,HG12,0.0900000
charmm,n,ILE,HG13,0.0900000
charmm,n,ILE,CD1,-0.2700000
charmm,n,ILE,HD11,0.0900000
charmm,n,ILE,HD12,0.0900000
charmm,n,ILE,HD13,0.0900000
charmm,n,ILE,C,0.5100000
charmm,n,ILE,O,-0.5100000
charmm,c,ILE,N,-0.4700000
charmm,c,ILE,H,0.3100000
charmm,c,ILE,CA,0.0700000
charmm,c,ILE,HA,0.0900000
charmm,c,ILE,CB,-0.0900000
charmm,c,ILE,HB,0.0900000
charmm,c,ILE,CG2,-0.2700000
charmm,c,ILE,HG21,0.0900000
charmm,c,ILE,HG22,0.0900000
charmm,c,ILE,HG23,0.0900000
charmm,c,ILE,CG1,-0.1800000
charmm,c,ILE,HG12,0.0900000
charmm,c,ILE,HG13,0.0900000
charmm,c,ILE,CD1,-0.2700000
charmm,c,ILE,HD11,0.0900000
charmm,c,ILE,HD12,0.0900000
charmm,c,ILE,HD13,0.0900000
charmm,c,ILE,C,0.3400000
charmm,c,ILE,O,-0.6700000
charmm,c,ILE,OXT,-0.6700000
charmm,n-,ILE,N,-0.9600000
charmm,n-,ILE,H1,0.3400000
charmm,n-,ILE,H2,0.3400000
charmm,n-,ILE,CA,0.1900000
charmm,n-,ILE,HA,0.0900000
charmm,n-,ILE,CB,-0.0900000
charmm,n-,ILE,HB,0.0900000
charmm,n-,ILE,CG2,-0.2700000
charmm,n-,ILE,HG21,0.0900000
charmm,n-,ILE,HG22,0.0900000
charmm,n-,ILE,HG23,0.0900000
charmm,n-,ILE,CG1,-0.1800000
charmm,n-,ILE,HG12,0.0900000
charmm,n-,ILE,HG13,0.0900000
charmm,n-,ILE,CD1,-0.2700000
charmm,n-,ILE,HD11,0.0900000
charmm,n-,ILE,HD12,0.0900000
charmm,n-,ILE,HD13,0.0900000
charmm,n-,ILE,C,0.5100000
charmm,n-,ILE,O,-0.5100000
charmm,c+,ILE,N,-0.4700000
charmm,c+,ILE,H,0.3100000
charmm,c+,ILE,CA,0.0700000
charmm,c+,ILE,HA,0.0900000
charmm,c+,ILE,CB,-0.0900000
charmm,c+,ILE,HB,0.0900000
charmm,c+,ILE,CG2,-0.2700000
charmm,c+,ILE,HG21,0.0900000
charmm,c+,ILE,HG22,0.0900000
charmm,c+,ILE,HG23,0.0900000
charmm,c+,ILE,CG1,-0.1800000
charmm,c+,ILE,HG12,0.0900000
charmm,c+,ILE,HG13,0.0900000
charmm,c+,ILE,CD1,-0.2700000
charmm,c+,ILE,HD11,0.0900000
charmm,c+,ILE,HD12,0.0900000
charmm,c+,ILE,HD13,0.0900000
charmm,c+,ILE,C,0.7200000
charmm,c+,ILE,O,-0.5500000
charmm,c+,ILE,OXT,-0.6100000
charmm,c+,ILE,HOXT,0.4400000
charmm,m,LEU,N,-0.4700000
charmm,m,LEU,H,0.3100000
charmm,m,LEU,CA,0.0700000
charmm,m,LEU,HA,0.0900000
charmm,m,LEU,CB,-0.1800000
charmm,m,LEU,HB2,0.0900000
charmm,m,LEU,HB3,0.0900000
charmm,m,LEU,CG,-0.0900000
charmm,m,LEU,HG,0.0900000
charmm,m,LEU,CD1,-0.2700000
charmm,m,LEU,HD11,0.0900000
charmm,m,LEU,HD12,0.0900000
charmm,m,LEU,HD13,0.0900000
charmm,m,LEU,CD2,-0.2700000
charmm,m,LEU,HD21,0.0900000
charmm,m,LEU,HD22,0.0900000
charmm,m,LEU,HD23,0.0900000
charmm,m,LEU,C,0.5100000
charmm,m,LEU,O,-0.5100000
charmm,n,LEU,N,-0.3000000
charmm,n,LEU,H1,0.3300000
charmm,n,LEU,H2,0.3300000
charmm,n,LEU,H3,0.3300000
charmm,n,LEU,CA,0.2100000
charmm,n,LEU,HA,0.1000000
charmm,n,LEU,CB,-0.1800000
charmm,n,LEU,HB2,0.0900000
charmm,n,LEU,HB3,0.0900000
charmm,n,LEU,CG,-0.0900000
charmm,n,LEU,HG,0.0900000
charmm,n,LEU,CD1,-0.2700000
charmm,n,LEU,HD11,0.0900000
charmm,n,LEU,HD12,0.0900000
charmm,n,LEU,HD13,0.0900000
charmm,n,LEU,CD2,-0.2700000
charmm,n,LEU,HD21,0.0900000
charmm,n,LEU,HD22,0.0900000
charmm,n,LEU,HD23,0.0900000
charmm,n,LEU,C,0.5100000
charmm,n,LEU,O,-0.5100000
charmm,c,LEU,N,-0.4700000
charmm,c,LEU,H,0.3100000
charmm,c,LEU,CA,0.0700000
charmm,c,LEU,HA,0.0900000
charmm,c,LEU,CB,-0.1800000
charmm,c,LEU,HB2,0.0900000
charmm,c,LEU,HB3,0.0900000
charmm,c,LEU,CG,-0.0900000
charmm,c,LEU,HG,0.0900000
charmm,c,LEU,CD1,-0.2700000
charmm,c,LEU,HD11,0.0900000
charmm,c,LEU,HD12,0.0900000
charmm,c,LEU,HD13,0.0900000
charmm,c,LEU,CD2,-0.2700000
charmm,c,LEU,HD21,0.0900000
charmm,c,LEU,HD22,0.0900000
charmm,c,LEU,HD23,0.0900000
charmm,c,LEU,C,0.3400000
charmm,c,LEU,O,-0.6700000
charmm,c,LEU,OXT,-0.6700000
charmm,n-,LEU,N,-0.9600000
charmm,n-,LEU,H1,0.3400000
charmm,n-,LEU,H2,0.3400000
charmm,n-,LEU,CA,0.1900000
charmm,n-,LEU,HA,0.0900000
charmm,n-,LEU,CB,-0.1800000
charmm,n-,LEU,HB2,0.0900000
charmm,n-,LEU,HB3,0.0900000
charmm,n-,LEU,CG,-0.0900000
charmm,n-,LEU,HG,0.0900000
charmm,n-,LEU,CD1,-0.2700000
charmm,n-,LEU,HD11,0.0900000
charmm,n-,LEU,HD12,0.0900000
charmm,n-,LEU,HD13,0.0900000
charmm,n-,LEU,CD2,-0.2700000
charmm,n-,LEU,HD21,0.0900000
charmm,n-,LEU,HD22,0.0900000
charmm,n-,LEU,HD23,0.0900000
charmm,n-,LEU,C,0.5100000
charmm,n-,LEU,O,-0.5100000
charmm,c+,LEU,N,-0.4700000
charmm,c+,LEU,H,0.3100000
charmm,c+,LEU,CA,0.0700000
charmm,c+,LEU,HA,0.0900000
charmm,c+,LEU,CB,-0.1800000
charmm,c+,LEU,HB2,0.0900000
charmm,c+,LEU,HB3,0.0900000
charmm,c+,LEU,CG,-0.0900000
charmm,c+,LEU,HG,0.0900000
charmm,c+,LEU,CD1,-0.2700000
charmm,c+,LEU,HD11,0.0900000
charmm,c+,LEU,HD12,0.0900000
charmm,c+,LEU,HD13,0.0900000
charmm,c+,LEU,CD2,-0.2700000
charmm,c+,LEU,HD21,0.0900000
charmm,c+,LEU,HD22,0.0900000
charmm,c+,LEU,HD23,0.0900000
charmm,c+,LEU,C,0.7200000
charmm,c+,LEU,O,-0.5500000
charmm,c+,LEU,OXT,-0.6100000
charmm,c+,LEU,HOXT,0.4400000
charmm,m,LYS,N,-0.4700000
charmm,m,LYS,H,0.3100000
charmm,m,LYS,CA,0.0700000
charmm,m,LYS,HA,0.0900000
charmm,m,LYS,CB,-0.1800000
charmm,m,LYS,HB2,0.0900000
charmm,m,LYS,HB3,0.0900000
charmm,m,LYS,CG,-0.1800000
charmm,m,LYS,HG2,0.0900000
charmm,m,LYS,HG3,0.0900000
charmm,m,LYS,CD,-0.1800000
charmm,m,LYS,HD2,0.0900000
charmm,m,LYS,HD3,0.0900000
charmm,m,LYS,CE,0.2100000
charmm,m,LYS,HE2,0.0500000
charmm,m,LYS,HE3,0.0500000
charmm,m,LYS,NZ,-0.3000000
charmm,m,LYS,HZ1,0.3300000
charmm,m,LYS,HZ2,0.3300000
charmm,m,LYS,HZ3,0.3300000
charmm,m,LYS,C,0.5100000
charmm,m,LYS,O,-0.5100000
charmm,n,LYS,N,-0.3000000
charmm,n,LYS,H1,0.3300000
charmm,n,LYS,H2,0.3300000
charmm,n,LYS,H3,0.3300000
charmm,n,LYS,CA,0.2100000
charmm,n,LYS,HA,0.1000000
charmm,n,LYS,CB,-0.1800000
charmm,n,LYS,HB2,0.0900000
charmm,n,LYS,HB3,0.0900000
charmm,n,LYS,CG,-0.1800000
charmm,n,LYS,HG2,0.0900000
charmm,n,LYS,HG3,0.0900000
charmm,n,LYS,CD,-0.1800000
charmm,n,LYS,HD2,0.0900000
charmm,n,LYS,HD3,0.0900000
charmm,n,LYS,CE,0.2100000
charmm,n,LYS,HE2,0.0500000
charmm,n,LYS,HE3,0.0500000
charmm,n,LYS,NZ,-0.3000000
charmm,n,LYS,HZ1,0.3300000
charmm,n,LYS,HZ2,0.3300000
charmm,n,LYS,HZ3,0.3300000
charmm,n,LYS,C,0.5100000
charmm,n,LYS,O,-0.5100000
charmm,c,LYS,N,-0.4700000
charmm,c,LYS,H,0.3100000
charmm,c,LYS,CA,0.0700000
charmm,c,LYS,HA,0.0900000
charmm,c,LYS,CB,-0.1800000
charmm,c,LYS,HB2,0.0900000
charmm,c,LYS,HB3,0.0900000
charmm,c,LYS,CG,-0.1800000
charmm,c,LYS,HG2,0.0900000
charmm,c,LYS,HG3,0.0900000
charmm,c,LYS,CD,-0.1800000
charmm,c,LYS,HD2,0.0900000
charmm,c,LYS,HD3,0.0900000
charmm,c,LYS,CE,0.2100000
charmm,c,LYS,HE2,0.0500000
charmm,c,LYS,HE3,0.0500000
charmm,c,LYS,NZ,-0.3000000
charmm,c,LYS,HZ1,0.3300000
charmm,c,LYS,HZ2,0.3300000
charmm,c,LYS,HZ3,0.3300000
charmm,c,LYS,C,0.3400000
charmm,c,LYS,O,-0.6700000
charmm,c,LYS,OXT,-0.6700000
charmm,n-,LYS,N,-0.9600000
charmm,n-,LYS,H1,0.3400000
charmm,n-,LYS,H2,0.3400000
charmm,n-,LYS,CA,0.1900000
charmm,n-,LYS,HA,0.0900000
charmm,n-,LYS,CB,-0.1800000
charmm,n-,LYS,HB2,0.0900000
charmm,n-,LYS,HB3,0.0900000
charmm,n-,LYS,CG,-0.1800000
charmm,n-,LYS,HG2,0.0900000
charmm,n-,LYS,HG3,0.0900000
charmm,n-,LYS,CD,-0.1800000
charmm,n-,LYS,HD2,0.0900000
charmm,n-,LYS,HD3,0.0900000
charmm,n-,LYS,CE,0.2100000
charmm,n-,LYS,HE2,0.0500000
charmm,n-,LYS,HE3,0.0500000
charmm,n-,LYS,NZ,-0.3000000
charmm,n-,LYS,HZ1,0.3300000
charmm,n-,LYS,HZ2,0.3300000
charmm,n-,LYS,HZ3,0.3300000
charmm,n-,LYS,C,0.5100000
charmm,n-,LYS,O,-0.5100000
charmm,c+,LYS,N,-0.4700000
charmm,c+,LYS,H,0.3100000
charmm,c+,LYS,CA,0.0700000
charmm,c+,LYS,HA,0.0900000
charmm,c+,LYS,CB,-0.1800000
charmm,c+,LYS,HB2,0.0900000
charmm,c+,LYS,HB3,0.0900000
charmm,c+,LYS,CG,-0.1800000
charmm,c+,LYS,HG2,0.0900000
charmm,c+,LYS,HG3,0.0900000
charmm,c+,LYS,CD,-0.1800000
charmm,c+,LYS,HD2,0.0900000
charmm,c+,LYS,HD3,0.0900000
charmm,c+,LYS,CE,0.2100000
charmm,c+,LYS,HE2,0.0500000
charmm,c+,LYS,HE3,0.0500000
charmm,c+,LYS,NZ,-0.3000000
charmm,c+,LYS,HZ1,0.3300000
charmm,c+,LYS,HZ2,0.3300000
charmm,c+,LYS,HZ3,0.3300000
charmm,c+,LYS,C,0.7200000
charmm,c+,LYS,O,-0.5500000
charmm,c+,LYS,OXT,-0.6100000
charmm,c+,LYS,HOXT,0.4400000
charmm,m,LYN,N,-0.4700000
charmm,m,LYN,H,0.3100000
charmm,m,LYN,CA,0.0700000
charmm,m,LYN,HA,0.0900000
charmm,m,LYN,CB,-0.1800000
charmm,m,LYN,HB2,0.0900000
charmm,m,LYN,HB3,0.0900000
charmm,m,LYN,CG,-0.1800000
charmm,m,LYN,HG2,0.0900000
charmm,m,LYN,HG3,0.0900000
charmm,m,LYN,CD,-0.1800000
charmm,m,LYN,HD2,0.0900000
charmm,m,LYN,HD3,0.0900000
charmm,m,LYN,CE,0.1300000
charmm,m,LYN,HE2,0.0750000
charmm,m,LYN,HE3,0.0750000
charmm,m,LYN,NZ,-0.9600000
charmm,m,LYN,HZ1,0.3400000
charmm,m,LYN,HZ2,0.3400000
charmm,m,LYN,C,0.5100000
charmm,m,LYN,O,-0.5100000
charmm,n,LYN,N,-0.3000000
charmm,n,LYN,H1,0.3300000
charmm,n,LYN,H2,0.3300000
charmm,n,LYN,H3,0.3300000
charmm,n,LYN,CA,0.2100000
charmm,n,LYN,HA,0.1000000
charmm,n,LYN,CB,-0.1800000
charmm,n,LYN,HB2,0.0900000
charmm,n,LYN,HB3,0.0900000
charmm,n,LYN,CG,-0.1800000
charmm,n,LYN,HG2,0.0900000
charmm,n,LYN,HG3,0.0900000
charmm,n,LYN,CD,-0.1800000
charmm,n,LYN,HD2,0.0900000
charmm,n,LYN,HD3,0.0900000
charmm,n,LYN,CE,0.1300000
charmm,n,LYN,HE2,0.0750000
charmm,n,LYN,HE3,0.0750000
charmm,n,LYN,NZ,-0.9600000
charmm,n,LYN,HZ1,0.3400000
charmm,n,LYN,HZ2,0.3400000
charmm,n,LYN,C,0.5100000
charmm,n,LYN,O,-0.5100000
charmm,c,LYN,N,-0.4700000
charmm,c,LYN,H,0.3100000
charmm,c,LYN,CA,0.0700000
charmm,c,LYN,HA,0.0900000
charmm,c,LYN,CB,-0.1800000
charmm,c,LYN,HB2,0.0900000
charmm,c,LYN,HB3,0.0900000
charmm,c,LYN,CG,-0.1800000
charmm,c,LYN,HG2,0.0900000
charmm,c,LYN,HG3,0.0900000
charmm,c,LYN,CD,-0.1800000
charmm,c,LYN,HD2,0.0900000
charmm,c,LYN,HD3,0.0900000
charmm,c,LYN,CE,0.1300000
charmm,c,LYN,HE2,0.0750000
charmm,c,LYN,HE3,0.0750000
charmm,c,LYN,NZ,-0.9600000
charmm,c,LYN,HZ1,0.3400000
charmm,c,LYN,HZ2,0.3400000
charmm,c,LYN,C,0.3400000
charmm,c,LYN,O,-0.6700000
charmm,c,LYN,OXT,-0.6700000
charmm,n-,LYN,N,-0.9600000
charmm,n-,LYN,H1,0.3400000
charmm,n-,LYN,H2,0.3400000
charmm,n-,LYN,CA,0.1900000
charmm,n-,LYN,HA,0.0900000
charmm,n-,LYN,CB,-0.1800000
charmm,n-,LYN,HB2,0.0900000
charmm,n-,LYN,HB3,0.0900000
charmm,n-,LYN,CG,-0.1800000
charmm,n-,LYN,HG2,0.0900000
charmm,n-,LYN,HG3,0.0900000
charmm,n-,LYN,CD,-0.1800000
charmm,n-,LYN,HD2,0.0900000
charmm,n-,LYN,HD3,0.0900000
charmm,n-,LYN,CE,0.1300000
charmm,n-,LYN,HE2,0.0750000
charmm,n-,LYN,HE3,0.0750000
charmm,n-,LYN,NZ,-0.9600000
charmm,n-,LYN,HZ1,0.3400000
charmm,n-,LYN,HZ2,0.3400000
charmm,n-,LYN,C,0.5100000
charmm,n-,LYN,O,-0.5100000
charmm,c+,LYN,N,-0.4700000
charmm,c+,LYN,H,0.3100000
charmm,c+,LYN,CA,0.0700000
charmm,c+,LYN,HA,0.0900000
charmm,c+,LYN,CB,-0.1800000
charmm,c+,LYN,HB2,0.0900000
charmm,c+,LYN,HB3,0.0900000
charmm,c+,LYN,CG,-0.1800000
charmm,c+,LYN,HG2,0.0900000
charmm,c+,LYN,HG3,0.0900000
charmm,c+,LYN,CD,-0.1800000
charmm,c+,LYN,HD2,0.0900000
charmm,c+,LYN,HD3,0.0900000
charmm,c+,LYN,CE,0.1300000
charmm,c+,LYN,HE2,0.0750000
charmm,c+,LYN,HE3,0.0750000
charmm,c+,LYN,NZ,-0.9600000
charmm,c+,LYN,HZ1,0.3400000
charmm,c+,LYN,HZ2,0.3400000
charmm,c+,LYN,C,0.7200000
charmm,c+,LYN,O,-0.5500000
charmm,c+,LYN,OXT,-0.6100000
charmm,c+,LYN,HOXT,0.4400000
charmm,m,MET,N,-0.4700000
charmm,m,MET,H,0.3100000
charmm,m,MET,CA,0.0700000
charmm,m,MET,HA,0.0900000
charmm,m,MET,CB,-0.1800000
charmm,m,MET,HB2,0.0900000
charmm,m,MET,HB3,0.0900000
charmm,m,MET,CG,-0.1400000
charmm,m,MET,HG2,0.0900000
charmm,m,MET,HG3,0.0900000
charmm,m,MET,SD,-0.0900000
charmm,m,MET,CE,-0.2200000
charmm,m,MET,HE1,0.0900000
charmm,m,MET,HE2,0.0900000
charmm,m,MET,HE3,0.0900000
charmm,m,MET,C,0.5100000
charmm,m,MET,O,-0.5100000
charmm,n,MET,N,-0.3000000
charmm,n,MET,H1,0.3300000
charmm,n,MET,H2,0.3300000
charmm,n,MET,H3,0.3300000
charmm,n,MET,CA,0.2100000
charmm,n,MET,HA,0.1000000
charmm,n,MET,CB,-0.1800000
charmm,n,MET,HB2,0.0900000
charmm,n,MET,HB3,0.0900000
charmm,n,MET,CG,-0.1400000
charmm,n,MET,HG2,0.0900000
charmm,n,MET,HG3,0.0900000
charmm,n,MET,SD,-0.0900000
charmm,n,MET,CE,-0.2200000
charmm,n,MET,HE1,0.0900000
charmm,n,MET,HE2,0.0900000
charmm,n,MET,HE3,0.0900000
charmm,n,MET,C,0.5100000
charmm,n,MET,O,-0.5100000
charmm,c,MET,N,-0.4700000
charmm,c,MET,H,0.3100000
charmm,c,MET,CA,0.0700000
charmm,c,MET,HA,0.0900000
charmm,c,MET,CB,-0.1800000
charmm,c,MET,HB2,0.0900000
charmm,c,MET,HB3,0.0900000
charmm,c,MET,CG,-0.1400000
charmm,c,MET,HG2,0.0900000
charmm,c,MET,HG3,0.0900000
charmm,c,MET,SD,-0.0900000
charmm,c,MET,CE,-0.2200000
charmm,c,MET,HE1,0.0900000
charmm,c,MET,HE2,0.0900000
charmm,c,MET,HE3,0.0900000
charmm,c,MET,C,0.3400000
charmm,c,MET,O,-0.6700000
charmm,c,MET,OXT,-0.6700000
charmm,n-,MET,N,-0.9600000
charmm,n-,MET,H1,0.3400000
charmm,n-,MET,H2,0.3400000
charmm,n-,MET,CA,0.1900000
charmm,n-,MET,HA,0.0900000
charmm,n-,MET,CB,-0.1800000
charmm,n-,MET,HB2,0.0900000
charmm,n-,MET,HB3,0.0900000
charmm,n-,MET,CG,-0.1400000
charmm,n-,MET,HG2,0.0900000
charmm,n-,MET,HG3,0.0900000
charmm,n-,MET,SD,-0.0900000
charmm,n-,MET,CE,-0.2200000
charmm,n-,MET,HE1,0.0900000
charmm,n-,MET,HE2,0.0900000
charmm,n-,MET,HE3,0.0900000
charmm,n-,MET,C,0.5100000
charmm,n-,MET,O,-0.5100000
charmm,c+,MET,N,-0.4700000
charmm,c+,MET,H,0.3100000
charmm,c+,MET,CA,0.0700000
charmm,c+,MET,HA,0.0900000
charmm,c+,MET,CB,-0.1800000
charmm,c+,MET,HB2,0.0900000
charmm,c+,MET,HB3,0.0900000
charmm,c+,MET,CG,-0.1400000
charmm,c+,MET,HG2,0.0900000
charmm,c+,MET,HG3,0.0900000
charmm,c+,MET,SD,-0.0900000
charmm,c+,MET,CE,-0.2200000
charmm,c+,MET,HE1,0.0900000
charmm,c+,MET,HE2,0.0900000
charmm,c+,MET,HE3,0.0900000
charmm,c+,MET,C,0.7200000
charmm,c+,MET,O,-0.5500000
charmm,c+,MET,OXT,-0.6100000
charmm,c+,MET,HOXT,0.4400000
charmm,m,PHE,N,-0.4700000
charmm,m,PHE,H,0.3100000
charmm,m,PHE,CA,0.0700000
charmm,m,PHE,HA,0.0900000
charmm,m,PHE,CB,-0.1800000
charmm,m,PHE,HB2,0.0900000
charmm,m,PHE,HB3,0.0900000
charmm,m,PHE,CG,0.0000000
charmm,m,PHE,CD1,-0.1150000
charmm,m,PHE,HD1,0.1150000
charmm,m,PHE,CD2,-0.1150000
charmm,m,PHE,HD2,0.1150000
charmm,m,PHE,CE1,-0.1150000
charmm,m,PHE,HE1,0.1150000
charmm,m,PHE,CE2,-0.1150000
charmm,m,PHE,HE2,0.1150000
charmm,m,PHE,CZ,-0.1150000
charmm,m,PHE,HZ,0.1150000
charmm,m,PHE,C,0.5100000
charmm,m,PHE,O,-0.5100000
charmm,n,PHE,N,-0.3000000
charmm,n,PHE,H1,0.3300000
charmm,n,PHE,H2,0.3300000
charmm,n,PHE,H3,0.3300000
charmm,n,PHE,CA,0.2100000
charmm,n,PHE,HA,0.1000000
charmm,n,PHE,CB,-0.1800000
charmm,n,PHE,HB2,0.0900000
charmm,n,PHE,HB3,0.0900000
charmm,n,PHE,CG,0.0000000
charmm,n,PHE,CD1,-0.1150000
charmm,n,PHE,HD1,0.1150000
charmm,n,PHE,CD2,-0.1150000
charmm,n,PHE,HD2,0.1150000
charmm,n,PHE,CE1,-0.1150000
charmm,n,PHE,HE1,0.1150000
charmm,n,PHE,CE2,-0.1150000
charmm,n,PHE,HE2,0.1150000
charmm,n,PHE,CZ,-0.1150000
charmm,n,PHE,HZ,0.1150000
charmm,n,PHE,C,0.5100000
charmm,n,PHE,O,-0.5100000
charmm,c,PHE,N,-0.4700000
charmm,c,PHE,H,0.3100000
charmm,c,PHE,CA,0.0700000
charmm,c,PHE,HA,0.0900000
charmm,c,PHE,CB,-0.1800000
charmm,c,PHE,HB2,0.0900000
charmm,c,PHE,HB3,0.0900000
charmm,c,PHE,CG,0.0000000
charmm,c,PHE,CD1,-0.1150000
charmm,c,PHE,HD1,0.1150000
charmm,c,PHE,CD2,-0.1150000
charmm,c,PHE,HD2,0.1150000
charmm,c,PHE,CE1,-0.1150000
charmm,c,PHE,HE1,0.1150000
charmm,c,PHE,CE2,-0.1150000
charmm,c,PHE,HE2,0.1150000
charmm,c,PHE,CZ,-0.1150000
charmm,c,PHE,HZ,0.1150000
charmm,c,PHE,C,0.3400000
charmm,c,PHE,O,-0.6700000
charmm,c,PHE,OXT,-0.6700000
charmm,n-,PHE,N,-0.9600000
charmm,n-,PHE,H1,0.3400000
charmm,n-,PHE,H2,0.3400000
charmm,n-,PHE,CA,0.1900000
charmm,n-,PHE,HA,0.0900000
charmm,n-,PHE,CB,-0.1800000
charmm,n-,PHE,HB2,0.0900000
charmm,n-,PHE,HB3,0.0900000
charmm,n-,PHE,CG,0.0000000
charmm,n-,PHE,CD1,-0.1150000
charmm,n-,PHE,HD1,0.1150000
charmm,n-,PHE,CD2,-0.1150000
charmm,n-,PHE,HD2,0.1150000
charmm,n-,PHE,CE1,-0.1150000
charmm,n-,PHE,HE1,0.1150000
charmm,n-,PHE,CE2,-0.1150000
charmm,n-,PHE,HE2,0.1150000
charmm,n-,PHE,CZ,-0.1150000
charmm,n-,PHE,HZ,0.1150000
charmm,n-,PHE,C,0.5100000
charmm,n-,PHE,O,-0.5100000
charmm,c+,PHE,N,-0.4700000
charmm,c+,PHE,H,0.3100000
charmm,c+,PHE,CA,0.0700000
charmm,c+,PHE,HA,0.0900000
charmm,c+,PHE,CB,-0.1800000
charmm,c+,PHE,HB2,0.0900000
charmm,c+,PHE,HB3,0.0900000
charmm,c+,PHE,CG,0.0000000
charmm,c+,PHE,CD1,-0.1150000
charmm,c+,PHE,HD1,0.1150000
charmm,c+,PHE,CD2,-0.1150000
charmm,c+,PHE,HD2,0.1150000
charmm,c+,PHE,CE1,-0.1150000
charmm,c+,PHE,HE1,0.1150000
charmm,c+,PHE,CE2,-0.1150000
charmm,c+,PHE,HE2,0.1150000
charmm,c+,PHE,CZ,-0.1150000
charmm,c+,PHE,HZ,0.1150000
charmm,c+,PHE,C,0.7200000
charmm,c+,PHE,O,-0.5500000
charmm,c+,PHE,OXT,-0.6100000
charmm,c+,PHE,HOXT,0.4400000
charmm,m,PRO,N,-0.2900000
charmm,m,PRO,CA,0.0200000
charmm,m,PRO,CB,-0.1800000
charmm,m,PRO,CG,-0.1800000
charmm,m,PRO,CD,0.0000000
charmm,m,PRO,HA,0.0900000
charmm,m,PRO,HB2,0.0900000
charmm,m,PRO,HB3,0.0900000
charmm,m,PRO,HG2,0.0900000
charmm,m,PRO,HG3,0.0900000
charmm,m,PRO,HD2,0.0900000
charmm,m,PRO,HD3,0.0900000
charmm,m,PRO,C,0.5100000
charmm,m,PRO,O,-0.5100000
charmm,n,PRO,N,-0.0700000
charmm,n,PRO,H2,0.2400000
charmm,n,PRO,H3,0.2400000
charmm,n,PRO,CA,0.1600000
charmm,n,PRO,CB,-0.1800000
charmm,n,PRO,CG,-0.1800000
charmm,n,PRO,CD,0.1600000
charmm,n,PRO,HA,0.0900000
charmm,n,PRO,HB2,0.0900000
charmm,n,PRO,HB3,0.0900000
charmm,n,PRO,HG2,0.0900000
charmm,n,PRO,HG3,0.0900000
charmm,n,PRO,HD2,0.0900000
charmm,n,PRO,HD3,0.0900000
charmm,n,PRO,C,0.5100000
charmm,n,PRO,O,-0.5100000
charmm,c,PRO,N,-0.2900000
charmm,c,PRO,CA,0.0200000
charmm,c,PRO,CB,-0.1800000
charmm,c,PRO,CG,-0.1800000
charmm,c,PRO,CD,0.0000000
charmm,c,PRO,HA,0.0900000
charmm,c,PRO,HB2,0.0900000
charmm,c,PRO,HB3,0.0900000
charmm,c,PRO,HG2,0.0900000
charmm,c,PRO,HG3,0.0900000
charmm,c,PRO,HD2,0.0900000
charmm,c,PRO,HD3,0.0900000
charmm,c,PRO,C,0.3400000
charmm,c,PRO,O,-0.6700000
charmm,c,PRO,OXT,-0.6700000
charmm,n-,PRO,N,-0.7700000
charmm,n-,PRO,H2,0.2500000
charmm,n-,PRO,CA,0.1400000
charmm,n-,PRO,CB,-0.1800000
charmm,n-,PRO,CG,-0.1800000
charmm,n-,PRO,CD,0.1400000
charmm,n-,PRO,HA,0.0800000
charmm,n-,PRO,HB2,0.0900000
charmm,n-,PRO,HB3,0.0900000
charmm,n-,PRO,HG2,0.0900000
charmm,n-,PRO,HG3,0.0900000
charmm,n-,PRO,HD2,0.0800000
charmm,n-,PRO,HD3,0.0800000
charmm,n-,PRO,C,0.5100000
charmm,n-,PRO,O,-0.5100000
charmm,c+,PRO,N,-0.2900000
charmm,c+,PRO,CA,0.0200000
charmm,c+,PRO,CB,-0.1800000
charmm,c+,PRO,CG,-0.1800000
charmm,c+,PRO,CD,0.0000000
charmm,c+,PRO,HA,0.0900000
charmm,c+,PRO,HB2,0.0900000
charmm,c+,PRO,HB3,0.0900000
charmm,c+,PRO,HG2,0.0900000
charmm,c+,PRO,HG3,0.0900000
charmm,c+,PRO,HD2,0.0900000
charmm,c+,PRO,HD3,0.0900000
charmm,c+,PRO,C,0.7200000
charmm,c+,PRO,O,-0.5500000
charmm,c+,PRO,OXT,-0.6100000
charmm,c+,PRO,HOXT,0.4400000
charmm,m,SER,N,-0.4700000
charmm,m,SER,H,0.3100000
charmm,m,SER,CA,0.0700000
charmm,m,SER,HA,0.0900000
charmm,m,SER,CB,0.0500000
charmm,m,SER,HB2,0.0900000
charmm,m,SER,HB3,0.0900000
charmm,m,SER,OG,-0.6600000
charmm,m,SER,HG,0.4300000
charmm,m,SER,C,0.5100000
charmm,m,SER,O,-0.5100000
charmm,n,SER,N,-0.3000000
charmm,n,SER,H1,0.3300000
charmm,n,SER,H2,0.3300000
charmm,n,SER,H3,0.3300000
charmm,n,SER,CA,0.2100000
charmm,n,SER,HA,0.1000000
charmm,n,SER,CB,0.0500000
charmm,n,SER,HB2,0.0900000
charmm,n,SER,HB3,0.0900000
charmm,n,SER,OG,-0.6600000
charmm,n,SER,HG,0.4300000
charmm,n,SER,C,0.5100000
charmm,n,SER,O,-0.5100000
charmm,c,SER,N,-0.4700000
charmm,c,SER,H,0.3100000
charmm,c,SER,CA,0.0700000
charmm,c,SER,HA,0.0900000
charmm,c,SER,CB,0.0500000
charmm,c,SER,HB2,0.0900000
charmm,c,SER,HB3,0.0900000
charmm,c,SER,OG,-0.6600000
charmm,c,SER,HG,0.4300000
charmm,c,SER,C,0.3400000
charmm,c,SER,O,-0.6700000
charmm,c,SER,OXT,-0.6700000
charmm,n-,SER,N,-0.9600000
charmm,n-,SER,H1,0.3400000
charmm,n-,SER,H2,0.3400000
charmm,n-,SER,CA,0.1900000
charmm,n-,SER,HA,0.0900000
charmm,n-,SER,CB,0.0500000
charmm,n-,SER,HB2,0.0900000
charmm,n-,SER,HB3,0.0900000
charmm,n-,SER,OG,-0.6600000
charmm,n-,SER,HG,0.4300000
charmm,n-,SER,C,0.5100000
charmm,n-,SER,O,-0.5100000
charmm,c+,SER,N,-0.4700000
charmm,c+,SER,H,0.3100000
charmm,c+,SER,CA,0.0700000
charmm,c+,SER,HA,0.0900000
charmm,c+,SER,CB,0.0500000
charmm,c+,SER,HB2,0.0900000
charmm,c+,SER,HB3,0.0900000
charmm,c+,SER,OG,-0.6600000
charmm,c+,SER,HG,0.4300000
charmm,c+,SER,C,0.7200000
charmm,c+,SER,O,-0.5500000
charmm,c+,SER,OXT,-0.6100000
charmm,c+,SER,HOXT,0.4400000
charmm,m,THR,N,-0.4700000
charmm,m,THR,H,0.3100000
charmm,m,THR,CA,0.0700000
charmm,m,THR,HA,0.0900000
charmm,m,THR,CB,0.1400000
charmm,m,THR,HB,0.0900000
charmm,m,THR,OG1,-0.6600000
charmm,m,THR,HG1,0.4300000
charmm,m,THR,CG2,-0.2700000
charmm,m,THR,HG21,0.0900000
charmm,m,THR,HG22,0.0900000
charmm,m,THR,HG23,0.0900000
charmm,m,THR,C,0.5100000
charmm,m,THR,O,-0.5100000
charmm,n,THR,N,-0.3000000
charmm,n,THR,H1,0.3300000
charmm,n,THR,H2,0.3300000
charmm,n,THR,H3,0.3300000
charmm,n,THR,CA,0.2100000
charmm,n,THR,HA,0.1000000
charmm,n,THR,CB,0.1400000
charmm,n,THR,HB,0.0900000
charmm,n,THR,OG1,-0.6600000
charmm,n,THR,HG1,0.4300000
charmm,n,THR,CG2,-0.2700000
charmm,n,THR,HG21,0.0900000
charmm,n,THR,HG22,0.0900000
charmm,n,THR,HG23,0.0900000
charmm,n,THR,C,0.5100000
charmm,n,THR,O,-0.5100000
charmm,c,THR,N,-0.4700000
charmm,c,THR,H,0.3100000
charmm,c,THR,CA,0.0700000
charmm,c,THR,HA,0.0900000
charmm,c,THR,CB,0.1400000
charmm,c,THR,HB,0.0900000
charmm,c,THR,OG1,-0.6600000
charmm,c,THR,HG1,0.4300000
charmm,c,THR,CG2,-0.2700000
charmm,c,THR,HG21,0.0900000
charmm,c,THR,HG22,0.0900000
charmm,c,THR,HG23,0.0900000
charmm,c,THR,C,0.3400000
charmm,c,THR,O,-0.6700000
charmm,c,THR,OXT,-0.6700000
charmm,n-,THR,N,-0.9600000
charmm,n-,THR,H1,0.3400000
charmm,n-,THR,H2,0.3400000
charmm,n-,THR,CA,0.1900000
charmm,n-,THR,HA,0.0900000
charmm,n-,THR,CB,0.1400000
charmm,n-,THR,HB,0.0900000
charmm,n-,THR,OG1,-0.6600000
charmm,n-,THR,HG1,0.4300000
charmm,n-,THR,CG2,-0.2700000
charmm,n-,THR,HG21,0.0900000
charmm,n-,THR,HG22,0.0900000
charmm,n-,THR,HG23,0.0900000
charmm,n-,THR,C,0.5100000
charmm,n-,THR,O,-0.5100000
charmm,c+,THR,N,-0.4700000
charmm,c+,THR,H,0.3100000
charmm,c+,THR,CA,0.0700000
charmm,c+,THR,HA,0.0900000
charmm,c+,THR,CB,0.1400000
charmm,c+,THR,HB,0.0900000
charmm,c+,THR,OG1,-0.6600000
charmm,c+,THR,HG1,0.4300000
charmm,c+,THR,CG2,-0.2700000
charmm,c+,THR,HG21,0.0900000
charmm,c+,THR,HG22,0.0900000
charmm,c+,THR,HG23,0.0900000
charmm,c+,THR,C,0.7200000
charmm,c+,THR,O,-0.5500000
charmm,c+,THR,OXT,-0.6100000
charmm,c+,THR,HOXT,0.4400000
charmm,m,TRP,N,-0.4700000
charmm,m,TRP,H,0.3100000
charmm,m,TRP,CA,0.0700000
charmm,m,TRP,HA,0.0900000
charmm,m,TRP,CB,-0.1800000
charmm,m,TRP,HB2,0.0900000
charmm,m,TRP,HB3,0.0900000
charmm,m,TRP,CG,-0.0300000
charmm,m,TRP,CD1,-0.1500000
charmm,m,TRP,HD1,0.2200000
charmm,m,TRP,NE1,-0.5100000
charmm,m,TRP,HE1,0.3700000
charmm,m,TRP,CE2,0.2400000
charmm,m,TRP,CD2,0.1100000
charmm,m,TRP,CE3,-0.2500000
charmm,m,TRP,HE3,0.1700000
charmm,m,TRP,CZ2,-0.2700000
charmm,m,TRP,HZ2,0.1600000
charmm,m,TRP,CZ3,-0.2000000
charmm,m,TRP,HZ3,0.1400000
charmm,m,TRP,CH2,-0.1400000
charmm,m,TRP,HH2,0.1400000
charmm,m,TRP,C,0.5100000
charmm,m,TRP,O,-0.5100000
charmm,n,TRP,N,-0.3000000
charmm,n,TRP,H1,0.3300000
charmm,n,TRP,H2,0.3300000
charmm,n,TRP,H3,0.3300000
charmm,n,TRP,CA,0.2100000
charmm,n,TRP,HA,0.1000000
charmm,n,TRP,CB,-0.1800000
charmm,n,TRP,HB2,0.0900000
charmm,n,TRP,HB3,0.0900000
charmm,n,TRP,CG,-0.0300000
charmm,n,TRP,CD1,-0.1500000
charmm,n,TRP,HD1,0.2200000
charmm,n,TRP,NE1,-0.5100000
charmm,n,TRP,HE1,0.3700000
charmm,n,TRP,CE2,0.2400000
charmm,n,TRP,CD2,0.1100000
charmm,n,TRP,CE3,-0.2500000
charmm,n,TRP,HE3,0.1700000
charmm,n,TRP,CZ2,-0.2700000
charmm,n,TRP,HZ2,0.1600000
charmm,n,TRP,CZ3,-0.2000000
charmm,n,TRP,HZ3,0.1400000
charmm,n,TRP,CH2,-0.1400000
charmm,n,TRP,HH2,0.1400000
charmm,n,TRP,C,0.5100000
charmm,n,TRP,O,-0.5100000
charmm,c,TRP,N,-0.4700000
charmm,c,TRP,H,0.3100000
charmm,c,TRP,CA,0.0700000
charmm,c,TRP,HA,0.0900000
charmm,c,TRP,CB,-0.1800000
charmm,c,TRP,HB2,0.0900000
charmm,c,TRP,HB3,0.0900000
charmm,c,TRP,CG,-0.0300000
charmm,c,TRP,CD1,-0.1500000
charmm,c,TRP,HD1,0.2200000
charmm,c,TRP,NE1,-0.5100000
charmm,c,TRP,HE1,0.3700000
charmm,c,TRP,CE2,0.2400000
charmm,c,TRP,CD2,0.1100000
charmm,c,TRP,CE3,-0.2500000
charmm,c,TRP,HE3,0.1700000
charmm,c,TRP,CZ2,-0.2700000
charmm,c,TRP,HZ2,0.1600000
charmm,c,TRP,CZ3,-0.2000000
charmm,c,TRP,HZ3,0.1400000
charmm,c,TRP,CH2,-0.1400000
charmm,c,TRP,HH2,0.1400000
charmm,c,TRP,C,0.3400000
charmm,c,TRP,O,-0.6700000
charmm,c,TRP,OXT,-0.6700000
charmm,n-,TRP,N,-0.9600000
charmm,n-,TRP,H1,0.3400000
charmm,n-,TRP,H2,0.3400000
charmm,n-,TRP,CA,0.1900000
charmm,n-,TRP,HA,0.0900000
charmm,n-,TRP,CB,-0.1800000
charmm,n-,TRP,HB2,0.0900000
charmm,n-,TRP,HB3,0.0900000
charmm,n-,TRP,CG,-0.0300000
charmm,n-,TRP,CD1,-0.1500000
charmm,n-,TRP,HD1,0.2200000
charmm,n-,TRP,NE1,-0.5100000
charmm,n-,TRP,HE1,0.3700000
charmm,n-,TRP,CE2,0.2400000
charmm,n-,TRP,CD2,0.1100000
charmm,n-,TRP,CE3,-0.2500000
charmm,n-,TRP,HE3,0.1700000
charmm,n-,TRP,CZ2,-0.2700000
charmm,n-,TRP,HZ2,0.1600000
charmm,n-,TRP,CZ3,-0.2000000
charmm,n-,TRP,HZ3,0.1400000
charmm,n-,TRP,CH2,-0.1400000
charmm,n-,TRP,HH2,0.1400000
charmm,n-,TRP,C,0.5100000
charmm,n-,TRP,O,-0.5100000
charmm,c+,TRP,N,-0.4700000
charmm,c+,TRP,H,0.3100000
charmm,c+,TRP,CA,0.0700000
charmm,c+,TRP,HA,0.0900000
charmm,c+,TRP,CB,-0.1800000
charmm,c+,TRP,HB2,0.0900000
charmm,c+,TRP,HB3,0.0900000
charmm,c+,TRP,CG,-0.0300000
charmm,c+,TRP,CD1,-0.1500000
charmm,c+,TRP,HD1,0.2200000
charmm,c+,TRP,NE1,-0.5100000
charmm,c+,TRP,HE1,0.3700000
charmm,c+,TRP,CE2,0.2400000
charmm,c+,TRP,CD2,0.1100000
charmm,c+,TRP,CE3,-0.2500000
charmm,c+,TRP,HE3,0.1700000
charmm,c+,TRP,CZ2,-0.2700000
charmm,c+,TRP,HZ2,0.1600000
charmm,c+,TRP,CZ3,-0.2000000
charmm,c+,TRP,HZ3,0.1400000
charmm,c+,TRP,CH2,-0.1400000
charmm,c+,TRP,HH2,0.1400000
charmm,c+,TRP,C,0.7200000
charmm,c+,TRP,O,-0.5500000
charmm,c+,TRP,OXT,-0.6100000
charmm,c+,TRP,HOXT,0.4400000
charmm,m,TYR,N,-0.4700000
charmm,m,TYR,H,0.3100000
charmm,m,TYR,CA,0.0700000
charmm,m,TYR,HA,0.0900000
charmm,m,TYR,CB,-0.1800000
charmm,m,TYR,HB2,0.0900000
charmm,m,TYR,HB3,0.0900000
charmm,m,TYR,CG,0.0000000
charmm,m,TYR,CD1,-0.1150000
charmm,m,TYR,HD1,0.1150000
charmm,m,TYR,CE1,-0.1150000
charmm,m,TYR,HE1,0.1150000
charmm,m,TYR,CD2,-0.1150000
charmm,m,TYR,HD2,0.1150000
charmm,m,TYR,CE2,-0.1150000
charmm,m,TYR,HE2,0.1150000
charmm,m,TYR,CZ,0.1100000
charmm,m,TYR,OH,-0.5400000
charmm,m,TYR,HH,0.4300000
charmm,m,TYR,C,0.5100000
charmm,m,TYR,O,-0.5100000
charmm,n,TYR,N,-0.3000000
charmm,n,TYR,H1,0.3300000
charmm,n,TYR,H2,0.3300000
charmm,n,TYR,H3,0.3300000
charmm,n,TYR,CA,0.2100000
charmm,n,TYR,HA,0.1000000
charmm,n,TYR,CB,-0.1800000
charmm,n,TYR,HB2,0.0900000
charmm,n,TYR,HB3,0.0900000
charmm,n,TYR,CG,0.0000000
charmm,n,TYR,CD1,-0.1150000
charmm,n,TYR,HD1,0.1150000
charmm,n,TYR,CE1,-0.1150000
charmm,n,TYR,HE1,0.1150000
charmm,n,TYR,CD2,-0.1150000
charmm,n,TYR,HD2,0.1150000
charmm,n,TYR,CE2,-0.1150000
charmm,n,TYR,HE2,0.1150000
charmm,n,TYR,CZ,0.1100000
charmm,n,TYR,OH,-0.5400000
charmm,n,TYR,HH,0.4300000
charmm,n,TYR,C,0.5100000
charmm,n,TYR,O,-0.5100000
charmm,c,TYR,N,-0.4700000
charmm,c,TYR,H,0.3100000
charmm,c,TYR,CA,0.0700000
charmm,c,TYR,HA,0.0900000
charmm,c,TYR,CB,-0.1800000
charmm,c,TYR,HB2,0.0900000
charmm,c,TYR,HB3,0.0900000
charmm,c,TYR,CG,0.0000000
charmm,c,TYR,CD1,-0.1150000
charmm,c,TYR,HD1,0.1150000
charmm,c,TYR,CE1,-0.1150000
charmm,c,TYR,HE1,0.1150000
charmm,c,TYR,CD2,-0.1150000
charmm,c,TYR,HD2,0.1150000
charmm,c,TYR,CE2,-0.1150000
charmm,c,TYR,HE2,0.1150000
charmm,c,TYR,CZ,0.1100000
charmm,c,TYR,OH,-0.5400000
charmm,c,TYR,HH,0.4300000
charmm,c,TYR,C,0.3400000
charmm,c,TYR,O,-0.6700000
charmm,c,TYR,OXT,-0.6700000
charmm,n-,TYR,N,-0.9600000
charmm,n-,TYR,H1,0.3400000
charmm,n-,TYR,H2,0.3400000
charmm,n-,TYR,CA,0.1900000
charmm,n-,TYR,HA,0.0900000
charmm,n-,TYR,CB,-0.1800000
charmm,n-,TYR,HB2,0.0900000
charmm,n-,TYR,HB3,0.0900000
charmm,n-,TYR,CG,0.0000000
charmm,n-,TYR,CD1,-0.1150000
charmm,n-,TYR,HD1,0.1150000
charmm,n-,TYR,CE1,-0.1150000
charmm,n-,TYR,HE1,0.1150000
charmm,n-,TYR,CD2,-0.1150000
charmm,n-,TYR,HD2,0.1150000
charmm,n-,TYR,CE2,-0.1150000
charmm,n-,TYR,HE2,0.1150000
charmm,n-,TYR,CZ,0.1100000
charmm,n-,TYR,OH,-0.5400000
charmm,n-,TYR,HH,0.4300000
charmm,n-,TYR,C,0.5100000
charmm,n-,TYR,O,-0.5100000
charmm,c+,TYR,N,-0.4700000
charmm,c+,TYR,H,0.3100000
charmm,c+,TYR,CA,0.0700000
charmm,c+,TYR,HA,0.0900000
charmm,c+,TYR,CB,-0.1800000
charmm,c+,TYR,HB2,0.0900000
charmm,c+,TYR,HB3,0.0900000
charmm,c+,TYR,CG,0.0000000
charmm,c+,TYR,CD1,-0.1150000
charmm,c+,TYR,HD1,0.1150000
charmm,c+,TYR,CE1,-0.1150000
charmm,c+,TYR,HE1,0.1150000
charmm,c+,TYR,CD2,-0.1150000
charmm,c+,TYR,HD2,0.1150000
charmm,c+,TYR,CE2,-0.1150000
charmm,c+,TYR,HE2,0.1150000
charmm,c+,TYR,CZ,0.1100000
charmm,c+,TYR,OH,-0.5400000
charmm,c+,TYR,HH,0.4300000
charmm,c+,TYR,C,0.7200000
charmm,c+,TYR,O,-0.5500000
charmm,c+,TYR,OXT,-0.6100000
charmm,c+,TYR,HOXT,0.4400000
charmm,m,TYM,N,-0.4700000
charmm,m,TYM,H,0.3100000
charmm,m,TYM,CA,0.0700000
charmm,m,TYM,HA,0.0900000
charmm,m,TYM,CB,-0.1800000
charmm,m,TYM,HB2,0.0900000
charmm,m,TYM,HB3,0.0900000
charmm,m,TYM,CG,-0.0380000
charmm,m,TYM,CD1,-0.1530000
charmm,m,TYM,HD1,0.1150000
charmm,m,TYM,CE1,-0.1530000
charmm,m,TYM,HE1,0.1150000
charmm,m,TYM,CD2,-0.1530000
charmm,m,TYM,HD2,0.1150000
charmm,m,TYM,CE2,-0.1530000
charmm,m,TYM,HE2,0.1150000
charmm,m,TYM,CZ,0.1100000
charmm,m,TYM,OH,-0.9200000
charmm,m,TYM,C,0.5100000
charmm,m,TYM,O,-0.5100000
charmm,n,TYM,N,-0.3000000
charmm,n,TYM,H1,0.3300000
charmm,n,TYM,H2,0.3300000
charmm,n,TYM,H3,0.3300000
charmm,n,TYM,CA,0.2100000
charmm,n,TYM,HA,0.1000000
charmm,n,TYM,CB,-0.1800000
charmm,n,TYM,HB2,0.0900000
charmm,n,TYM,HB3,0.0900000
charmm,n,TYM,CG,-0.0380000
charmm,n,TYM,CD1,-0.1530000
charmm,n,TYM,HD1,0.1150000
charmm,n,TYM,CE1,-0.1530000
charmm,n,TYM,HE1,0.1150000
charmm,n,TYM,CD2,-0.1530000
charmm,n,TYM,HD2,0.1150000
charmm,n,TYM,CE2,-0.1530000
charmm,n,TYM,HE2,0.1150000
charmm,n,TYM,CZ,0.1100000
charmm,n,TYM,OH,-0.9200000
charmm,n,TYM,C,0.5100000
charmm,n,TYM,O,-0.5100000
charmm,c,TYM,N,-0.4700000
charmm,c,TYM,H,0.3100000
charmm,c,TYM,CA,0.0700000
charmm,c,TYM,HA,0.0900000
charmm,c,TYM,CB,-0.1800000
charmm,c,TYM,HB2,0.0900000
charmm,c,TYM,HB3,0.0900000
charmm,c,TYM,CG,-0.0380000
charmm,c,TYM,CD1,-0.1530000
charmm,c,TYM,HD1,0.1150000
charmm,c,TYM,CE1,-0.1530000
charmm,c,TYM,HE1,0.1150000
charmm,c,TYM,CD2,-0.1530000
charmm,c,TYM,HD2,0.1150000
charmm,c,TYM,CE2,-0.1530000
charmm,c,TYM,HE2,0.1150000
charmm,c,TYM,CZ,0.1100000
charmm,c,TYM,OH,-0.9200000
charmm,c,TYM,C,0.3400000
charmm,c,TYM,O,-0.6700000
charmm,c,TYM,OXT,-0.6700000
charmm,n-,TYM,N,-0.9600000
charmm,n-,TYM,H1,0.3400000
charmm,n-,TYM,H2,0.3400000
charmm,n-,TYM,CA,0.1900000
charmm,n-,TYM,HA,0.0900000
charmm,n-,TYM,CB,-0.1800000
charmm,n-,TYM,HB2,0.0900000
charmm,n-,TYM,HB3,0.0900000
charmm,n-,TYM,CG,-0.0380000
charmm,n-,TYM,CD1,-0.1530000
charmm,n-,TYM,HD1,0.1150000
charmm,n-,TYM,CE1,-0.1530000
charmm,n-,TYM,HE1,0.1150000
charmm,n-,TYM,CD2,-0.1530000
charmm,n-,TYM,HD2,0.1150000
charmm,n-,TYM,CE2,-0.1530000
charmm,n-,TYM,HE2,0.1150000
charmm,n-,TYM,CZ,0.1100000
charmm,n-,TYM,OH,-0.9200000
charmm,n-,TYM,C,0.5100000
charmm,n-,TYM,O,-0.5100000
charmm,c+,TYM,N,-0.4700000
charmm,c+,TYM,H,0.3100000
charmm,c+,TYM,CA,0.0700000
charmm,c+,TYM,HA,0.0900000
charmm,c+,TYM,CB,-0.1800000
charmm,c+,TYM,HB2,0.0900000
charmm,c+,TYM,HB3,0.0900000
charmm,c+,TYM,CG,-0.0380000
charmm,c+,TYM,CD1,-0.1530000
charmm,c+,TYM,HD1,0.1150000
charmm,c+,TYM,CE1,-0.1530000
charmm,c+,TYM,HE1,0.1150000
charmm,c+,TYM,CD2,-0.1530000
charmm,c+,TYM,HD2,0.1150000
charmm,c+,TYM,CE2,-0.1530000
charmm,c+,TYM,HE2,0.1150000
charmm,c+,TYM,CZ,0.1100000
charmm,c+,TYM,OH,-0.9200000
charmm,c+,TYM,C,0.7200000
charmm,c+,TYM,O,-0.5500000
charmm,c+,TYM,OXT,-0.6100000
charmm,c+,TYM,HOXT,0.4400000
charmm,m,VAL,N,-0.4700000
charmm,m,VAL,H,0.3100000
charmm,m,VAL,CA,0.0700000
charmm,m,VAL,HA,0.0900000
charmm,m,VAL,CB,-0.0900000
charmm,m,VAL,HB,0.0900000
charmm,m,VAL,CG1,-0.2700000
charmm,m,VAL,HG11,0.0900000
charmm,m,VAL,HG12,0.0900000
charmm,m,VAL,HG13,0.0900000
charmm,m,VAL,CG2,-0.2700000
charmm,m,VAL,HG21,0.0900000
charmm,m,VAL,HG22,0.0900000
charmm,m,VAL,HG23,0.0900000
charmm,m,VAL,C,0.5100000
charmm,m,VAL,O,-0.5100000
charmm,n,VAL,N,-0.3000000
charmm,n,VAL,H1,0.3300000
charmm,n,VAL,H2,0.3300000
charmm,n,VAL,H3,0.3300000
charmm,n,VAL,CA,0.2100000
charmm,n,VAL,HA,0.1000000
charmm,n,VAL,CB,-0.0900000
charmm,n,VAL,HB,0.0900000
charmm,n,VAL,CG1,-0.2700000
charmm,n,VAL,HG11,0.0900000
charmm,n,VAL,HG12,0.0900000
charmm,n,VAL,HG13,0.0900000
charmm,n,VAL,CG2,-0.2700000
charmm,n,VAL,HG21,0.0900000
charmm,n,VAL,HG22,0.0900000
charmm,n,VAL,HG23,0.0900000
charmm,n,VAL,C,0.5100000
charmm,n,VAL,O,-0.5100000
charmm,c,VAL,N,-0.4700000
charmm,c,VAL,H,0.3100000
charmm,c,VAL,CA,0.0700000
charmm,c,VAL,HA,0.0900000
charmm,c,VAL,CB,-0.0900000
charmm,c,VAL,HB,0.0900000
charmm,c,VAL,CG1,-0.2700000
charmm,c,VAL,HG11,0.0900000
charmm,c,VAL,HG12,0.0900000
charmm,c,VAL,HG13,0.0900000
charmm,c,VAL,CG2,-0.2700000
charmm,c,VAL,HG21,0.0900000
charmm,c,VAL,HG22,0.0900000
charmm,c,VAL,HG23,0.0900000
charmm,c,VAL,C,0.3400000
charmm,c,VAL,O,-0.6700000
charmm,c,VAL,OXT,-0.6700000
charmm,n-,VAL,N,-0.9600000
charmm,n-,VAL,H1,0.3400000
charmm,n-,VAL,H2,0.3400000
charmm,n-,VAL,CA,0.1900000
charmm,n-,VAL,HA,0.0900000
charmm,n-,VAL,CB,-0.0900000
charmm,n-,VAL,HB,0.0900000
charmm,n-,VAL,CG1,-0.2700000
charmm,n-,VAL,HG11,0.0900000
charmm,n-,VAL,HG12,0.0900000
charmm,n-,VAL,HG13,0.0900000
charmm,n-,VAL,CG2,-0.2700000
charmm,n-,VAL,HG21,0.0900000
charmm,n-,VAL,HG22,0.0900000
charmm,n-,VAL,HG23,0.0900000
charmm,n-,VAL,C,0.5100000
charmm,n-,VAL,O,-0.5100000
charmm,c+,VAL,N,-0.4700000
charmm,c+,VAL,H,0.3100000
charmm,c+,VAL,CA,0.0700000
charmm,c+,VAL,HA,0.0900000
charmm,c+,VAL,CB,-0.0900000
charmm,c+,VAL,HB,0.0900000
charmm,c+,VAL,CG1,-0.2700000
charmm,c+,VAL,HG11,0.0900000
charmm,c+,VAL,HG12,0.0900000
charmm,c+,VAL,HG13,0.0900000
charmm,c+,VAL,CG2,-0.2700000
charmm,c+,VAL,HG21,0.0900000
charmm,c+,VAL,HG22,0.0900000
charmm,c+,VAL,HG23,0.0900000
charmm,c+,VAL,C,0.7200000
charmm,c+,VAL,O,-0.5500000
charmm,c+,VAL,OXT,-0.6100000
charmm,c+,VAL,HOXT,0.4400000
amber,m,DA,P,1.1659000
amber,m,DA,OP1,-0.7761000
amber,m,DA,OP2,-0.7761000
amber,m,DA,O5',-0.4954000
amber,m,DA,C5',-0.0069000
amber,m,DA,C4',0.1629000
amber,m,DA,O4',-0.3691000
amber,m,DA,C3',0.0713000
amber,m,DA,O3',-0.5232000
amber,m,DA,C2',-0.0854000
amber,m,DA,C1',0.0431000
amber,m,DA,N9,-0.0268000
amber,m,DA,C8,0.1607000
amber,m,DA,N7,-0.6175000
amber,m,DA,C5,0.0725000
amber,m,DA,C6,0.6897000
amber,m,DA,N6,-0.9123000
amber,m,DA,N1,-0.7624000
amber,m,DA,C2,0.5716000
amber,m,DA,N3,-0.7417000
amber,m,DA,C4,0.3800000
amber,m,DA,H5',0.0754000
amber,m,DA,H5'',0.0754000
amber,m,DA,H4',0.1176000
amber,m,DA,H3',0.0985000
amber,m,DA,H2',0.0718000
amber,m,DA,H2'',0.0718000
amber,m,DA,H1',0.1838000
amber,m,DA,H8,0.1877000
amber,m,DA,H61,0.4167000
amber,m,DA,H62,0.4167000
amber,m,DA,H2,0.0598000
amber,5,DA,O5',-0.6318000
amber,5,DA,C5',-0.0069000
amber,5,DA,C4',0.1629000
amber,5,DA,O4',-0.3691000
amber,5,DA,C3',0.0713000
amber,5,DA,O3',-0.5232000
amber,5,DA,C2',-0.0854000
amber,5,DA,C1',0.0431000
amber,5,DA,N9,-0.0268000
amber,5,DA,C8,0.1607000
amber,5,DA,N7,-0.6175000
amber,5,DA,C5,0.0725000
amber,5,DA,C6,0.6897000
amber,5,DA,N6,-0.9123000
amber,5,DA,N1,-0.7624000
amber,5,DA,C2,0.5716000
amber,5,DA,N3,-0.7417000
amber,5,DA,C4,0.3800000
amber,5,DA,H5',0.0754000
amber,5,DA,H5'',0.0754000
amber,5,DA,H4',0.1176000
amber,5,DA,H3',0.0985000
amber,5,DA,H2',0.0718000
amber,5,DA,H2'',0.0718000
amber,5,DA,H1',0.1838000
amber,5,DA,HO5',0.4422000
amber,5,DA,H8,0.1877000
amber,5,DA,H61,0.4167000
amber,5,DA,H62,0.4167000
amber,5,DA,H2,0.0598000
amber,3,DA,P,1.1659000
amber,3,DA,OP1,-0.7761000
amber,3,DA,OP2,-0.7761000
amber,3,DA,O5',-0.4954000
amber,3,DA,C5',-0.0069000
amber,3,DA,C4',0.1629000
amber,3,DA,O4',-0.3691000
amber,3,DA,C3',0.0713000
amber,3,DA,O3',-0.6549000
amber,3,DA,C2',-0.0854000
amber,3,DA,C1',0.0431000
amber,3,DA,N9,-0.0268000
amber,3,DA,C8,0.1607000
amber,3,DA,N7,-0.6175000
amber,3,DA,C5,0.0725000
amber,3,DA,C6,0.6897000
amber,3,DA,N6,-0.9123000
amber,3,DA,N1,-0.7624000
amber,3,DA,C2,0.5716000
amber,3,DA,N3,-0.7417000
amber,3,DA,C4,0.3800000
amber,3,DA,H5',0.0754000
amber,3,DA,H5'',0.0754000
amber,3,DA,H4',0.1176000
amber,3,DA,H3',0.0985000
amber,3,DA,H2',0.0718000
amber,3,DA,H2'',0.0718000
amber,3,DA,H1',0.1838000
amber,3,DA,HO3',0.4396000
amber,3,DA,H8,0.1877000
amber,3,DA,H61,0.4167000
amber,3,DA,H62,0.4167000
amber,3,DA,H2,0.0598000
amber,m,DT,P,1.1659000
amber,m,DT,OP1,-0.7761000
amber,m,DT,OP2,-0.7761000
amber,m,DT,O5',-0.4954000
amber,m,DT,C5',-0.0069000
amber,m,DT,C4',0.1629000
amber,m,DT,O4',-0.3691000
amber,m,DT,C3',0.0713000
amber,m,DT,O3',-0.5232000
amber,m,DT,C2',-0.0854000
amber,m,DT,C1',0.0680000
amber,m,DT,N1,-0.0239000
amber,m,DT,C2,0.5677000
amber,m,DT,O2,-0.5881000
amber,m,DT,N3,-0.4340000
amber,m,DT,C4,0.5194000
amber,m,DT,O4,-0.5563000
amber,m,DT,C5,0.0025000
amber,m,DT,C7,-0.2269000
amber,m,DT,C6,-0.2209000
amber,m,DT,H5',0.0754000
amber,m,DT,H5'',0.0754000
amber,m,DT,H4',0.1176000
amber,m,DT,H3',0.0985000
amber,m,DT,H2',0.0718000
amber,m,DT,H2'',0.0718000
amber,m,DT,H1',0.1804000
amber,m,DT,H3,0.3420000
amber,m,DT,H71,0.0770000
amber,m,DT,H72,0.0770000
amber,m,DT,H73,0.0770000
amber,m,DT,H6,0.2607000
amber,5,DT,O5',-0.6318000
amber,5,DT,C5',-0.0069000
amber,5,DT,C4',0.1629000
amber,5,DT,O4',-0.3691000
amber,5,DT,C3',0.0713000
amber,5,DT,O3',-0.5232000
amber,5,DT,C2',-0.0854000
amber,5,DT,C1',0.0680000
amber,5,DT,N1,-0.0239000
amber,5,DT,C2,0.5677000
amber,5,DT,O2,-0.5881000
amber,5,DT,N3,-0.4340000
amber,5,DT,C4,0.5194000
amber,5,DT,O4,-0.5563000
amber,5,DT,C5,0.0025000
amber,5,DT,C7,-0.2269000
amber,5,DT,C6,-0.2209000
amber,5,DT,H5',0.0754000
amber,5,DT,H5'',0.0754000
amber,5,DT,H4',0.1176000
amber,5,DT,H3',0.0985000
amber,5,DT,H2',0.0718000
amber,5,DT,H2'',0.0718000
amber,5,DT,H1',0.1804000
amber,5,DT,HO5',0.4422000
amber,5,DT,H3,0.3420000
amber,5,DT,H71,0.0770000
amber,5,DT,H72,0.0770000
amber,5,DT,H73,0.0770000
amber,5,DT,H6,0.2607000
amber,3,DT,P,1.1659000
amber,3,DT,OP1,-0.7761000
amber,3,DT,OP2,-0.7761000
amber,3,DT,O5',-0.4954000
amber,3,DT,C5',-0.0069000
amber,3,DT,C4',0.1629000
amber,3,DT,O4',-0.3691000
amber,3,DT,C3',0.0713000
amber,3,DT,O3',-0.6549000
amber,3,DT,C2',-0.0854000
amber,3,DT,C1',0.0680000
amber,3,DT,N1,-0.0239000
amber,3,DT,C2,0.5677000
amber,3,DT,O2,-0.5881000
amber,3,DT,N3,-0.4340000
amber,3,DT,C4,0.5194000
amber,3,DT,O4,-0.5563000
amber,3,DT,C5,0.0025000
amber,3,DT,C7,-0.2269000
amber,3,DT,C6,-0.2209000
amber,3,DT,H5',0.0754000
amber,3,DT,H5'',0.0754000
amber,3,DT,H4',0.1176000
amber,3,DT,H3',0.0985000
amber,3,DT,H2',0.0718000
amber,3,DT,H2'',0.0718000
amber,3,DT,H1',0.1804000
amber,3,DT,HO3',0.4396000
amber,3,DT,H3,0.3420000
amber,3,DT,H71,0.0770000
amber,3,DT,H72,0.0770000
amber,3,DT,H73,0.0770000
amber,3,DT,H6,0.2607000
amber,m,DG,P,1.1659000
amber,m,DG,OP1,-0.7761000
amber,m,DG,OP2,-0.7761000
amber,m,DG,O5',-0.4954000
amber,m,DG,C5',-0.0069000
amber,m,DG,C4',0.1629000
amber,m,DG,O4',-0.3691000
amber,m,DG,C3',0.0713000
amber,m,DG,O3',-0.5232000
amber,m,DG,C2',-0.0854000
amber,m,DG,C1',0.0358000
amber,m,DG,N9,0.0577000
amber,m,DG,C8,0.0736000
amber,m,DG,N7,-0.5725000
amber,m,DG,C5,0.1991000
amber,m,DG,C6,0.4918000
amber,m,DG,O6,-0.5699000
amber,m,DG,N1,-0.5053000
amber,m,DG,C2,0.7432000
amber,m,DG,N2,-0.9230000
amber,m,DG,N3,-0.6636000
amber,m,DG,C4,0.1814000
amber,m,DG,H5',0.0754000
amber,m,DG,H5'',0.0754000
amber,m,DG,H4',0.1176000
amber,m,DG,H3',0.0985000
amber,m,DG,H2',0.0718000
amber,m,DG,H2'',0.0718000
amber,m,DG,H1',0.1746000
amber,m,DG,H8,0.1997000
amber,m,DG,H1,0.3520000
amber,m,DG,H21,0.4235000
amber,m,DG,H22,0.4235000
amber,5,DG,O5',-0.6318000
amber,5,DG,C5',-0.0069000
amber,5,DG,C4',0.1629000
amber,5,DG,O4',-0.3691000
amber,5,DG,C3',0.0713000
amber,5,DG,O3',-0.5232000
amber,5,DG,C2',-0.0854000
amber,5,DG,C1',0.0358000
amber,5,DG,N9,0.0577000
amber,5,DG,C8,0.0736000
amber,5,DG,N7,-0.5725000
amber,5,DG,C5,0.1991000
amber,5,DG,C6,0.4918000
amber,5,DG,O6,-0.5699000
amber,5,DG,N1,-0.5053000
amber,5,DG,C2,0.7432000
amber,5,DG,N2,-0.9230000
amber,5,DG,N3,-0.6636000
amber,5,DG,C4,0.1814000
amber,5,DG,H5',0.0754000
amber,5,DG,H5'',0.0754000
amber,5,DG,H4',0.1176000
amber,5,DG,H3',0.0985000
amber,5,DG,H2',0.0718000
amber,5,DG,H2'',0.0718000
amber,5,DG,H1',0.1746000
amber,5,DG,HO5',0.4422000
amber,5,DG,H8,0.1997000
amber,5,DG,H1,0.3520000
amber,5,DG,H21,0.4235000
amber,5,DG,H22,0.4235000
amber,3,DG,P,1.1659000
amber,3,DG,OP1,-0.7761000
amber,3,DG,OP2,-0.7761000
amber,3,DG,O5',-0.4954000
amber,3,DG,C5',-0.0069000
amber,3,DG,C4',0.1629000
amber,3,DG,O4',-0.3691000
amber,3,DG,C3',0.0713000
amber,3,DG,O3',-0.6549000
amber,3,DG,C2',-0.0854000
amber,3,DG,C1',0.0358000
amber,3,DG,N9,0.0577000
amber,3,DG,C8,0.0736000
amber,3,DG,N7,-0.5725000
amber,3,DG,C5,0.1991000
amber,3,DG,C6,0.4918000
amber,3,DG,O6,-0.5699000
amber,3,DG,N1,-0.5053000
amber,3,DG,C2,0.7432000
amber,3,DG,N2,-0.9230000
amber,3,DG,N3,-0.6636000
amber,3,DG,C4,0.1814000
amber,3,DG,H5',0.0754000
amber,3,DG,H5'',0.0754000
amber,3,DG,H4',0.1176000
amber,3,DG,H3',0.0985000
amber,3,DG,H2',0.0718000
amber,3,DG,H2'',0.0718000
amber,3,DG,H1',0.1746000
amber,3,DG,HO3',0.4396000
amber,3,DG,H8,0.1997000
amber,3,DG,H1,0.3520000
amber,3,DG,H21,0.4235000
amber,3,DG,H22,0.4235000
amber,m,DC,P,1.1659000
amber,m,DC,OP1,-0.7761000
amber,m,DC,OP2,-0.7761000
amber,m,DC,O5',-0.4954000
amber,m,DC,C5',-0.0069000
amber,m,DC,C4',0.1629000
amber,m,DC,O4',-0.3691000
amber,m,DC,C3',0.0713000
amber,m,DC,O3',-0.5232000
amber,m,DC,C2',-0.0854000
amber,m,DC,C1',-0.0116000
amber,m,DC,N1,-0.0339000
amber,m,DC,C2,0.7959000
amber,m,DC,O2,-0.6548000
amber,m,DC,N3,-0.7748000
amber,m,DC,C4,0.8439000
amber,m,DC,N4,-0.9773000
amber,m,DC,C5,-0.5222000
amber,m,DC,C6,-0.0183000
amber,m,DC,H5',0.0754000
amber,m,DC,H5'',0.0754000
amber,m,DC,H4',0.1176000
amber,m,DC,H3',0.0985000
amber,m,DC,H2',0.0718000
amber,m,DC,H2'',0.0718000
amber,m,DC,H1',0.1963000
amber,m,DC,H41,0.4314000
amber,m,DC,H42,0.4314000
amber,m,DC,H5,0.1863000
amber,m,DC,H6,0.2293000
amber,5,DC,O5',-0.6318000
amber,5,DC,C5',-0.0069000
amber,5,DC,C4',0.1629000
amber,5,DC,O4',-0.3691000
amber,5,DC,C3',0.0713000
amber,5,DC,O3',-0.5232000
amber,5,DC,C2',-0.0854000
amber,5,DC,C1',-0.0116000
amber,5,DC,N1,-0.0339000
amber,5,DC,C2,0.7959000
amber,5,DC,O2,-0.6548000
amber,5,DC,N3,-0.7748000
amber,5,DC,C4,0.8439000
amber,5,DC,N4,-0.9773000
amber,5,DC,C5,-0.5222000
amber,5,DC,C6,-0.0183000
amber,5,DC,H5',0.0754000
amber,5,DC,H5'',0.0754000
amber,5,DC,H4',0.1176000
amber,5,DC,H3',0.0985000
amber,5,DC,H2',0.0718000
amber,5,DC,H2'',0.0718000
amber,5,DC,H1',0.1963000
amber,5,DC,HO5',0.4422000
amber,5,DC,H41,0.4314000
amber,5,DC,H42,0.4314000
amber,5,DC,H5,0.1863000
amber,5,DC,H6,0.2293000
amber,3,DC,P,1.1659000
amber,3,DC,OP1,-0.7761000
amber,3,DC,OP2,-0.7761000
amber,3,DC,O5',-0.4954000
amber,3,DC,C5',-0.0069000
amber,3,DC,C4',0.1629000
amber,3,DC,O4',-0.3691000
amber,3,DC,C3',0.0713000
amber,3,DC,O3',-0.6549000
amber,3,DC,C2',-0.0854000
amber,3,DC,C1',-0.0116000
amber,3,DC,N1,-0.0339000
amber,3,DC,C2,0.7959000
amber,3,DC,O2,-0.6548000
amber,3,DC,N3,-0.7748000
amber,3,DC,C4,0.8439000
amber,3,DC,N4,-0.9773000
amber,3,DC,C5,-0.5222000
amber,3,DC,C6,-0.0183000
amber,3,DC,H5',0.0754000
amber,3,DC,H5'',0.0754000
amber,3,DC,H4',0.1176000
amber,3,DC,H3',0.0985000
amber,3,DC,H2',0.0718000
amber,3,DC,H2'',0.0718000
amber,3,DC,H1',0.1963000
amber,3,DC,HO3',0.4396000
amber,3,DC,H41,0.4314000
amber,3,DC,H42,0.4314000
amber,3,DC,H5,0.1863000
amber,3,DC,H6,0.2293000
amber,m,DI,P,1.1659000
amber,m,DI,OP1,-0.7761000
amber,m,DI,OP2,-0.7761000
amber,m,DI,O5',-0.4954000
amber,m,DI,C5',-0.0069000
amber,m,DI,C4',0.1629000
amber,m,DI,O4',-0.3691000
amber,m,DI,C3',0.0713000
amber,m,DI,O3',-0.5232000
amber,m,DI,C2',-0.0854000
amber,m,DI,C1',0.0358000
amber,m,DI,N9,0.0577000
amber,m,DI,C8,0.0736000
amber,m,DI,N7,-0.5725000
amber,m,DI,C5,0.1991000
amber,m,DI,C6,0.4918000
amber,m,DI,O6,-0.5699000
amber,m,DI,N1,-0.5053000
amber,m,DI,C2,0.6074000
amber,m,DI,N3,-0.6636000
amber,m,DI,C4,0.1814000
amber,m,DI,H5',0.0754000
amber,m,DI,H5'',0.0754000
amber,m,DI,H4',0.1176000
amber,m,DI,H3',0.0985000
amber,m,DI,H2',0.0718000
amber,m,DI,H2'',0.0718000
amber,m,DI,H1',0.1746000
amber,m,DI,H8,0.1997000
amber,m,DI,H1,0.3520000
amber,m,DI,H2,0.0598000
amber,5,DI,O5',-0.6318000
amber,5,DI,C5',-0.0069000
amber,5,DI,C4',0.1629000
amber,5,DI,O4',-0.3691000
amber,5,DI,C3',0.0713000
amber,5,DI,O3',-0.5232000
amber,5,DI,C2',-0.0854000
amber,5,DI,C1',0.0358000
amber,5,DI,N9,0.0577000
amber,5,DI,C8,0.0736000
amber,5,DI,N7,-0.5725000
amber,5,DI,C5,0.1991000
amber,5,DI,C6,0.4918000
amber,5,DI,O6,-0.5699000
amber,5,DI,N1,-0.5053000
amber,5,DI,C2,0.6074000
amber,5,DI,N3,-0.6636000
amber,5,DI,C4,0.1814000
amber,5,DI,H5',0.0754000
amber,5,DI,H5'',0.0754000
amber,5,DI,H4',0.1176000
amber,5,DI,H3',0.0985000
amber,5,DI,H2',0.0718000
amber,5,DI,H2'',0.0718000
amber,5,DI,H1',0.1746000
amber,5,DI,HO5',0.4422000
amber,5,DI,H8,0.1997000
amber,5,DI,H1,0.3520000
amber,5,DI,H2,0.0598000
amber,3,DI,P,1.1659000
amber,3,DI,OP1,-0.7761000
amber,3,DI,OP2,-0.7761000
amber,3,DI,O5',-0.4954000
amber,3,DI,C5',-0.0069000
amber,3,DI,C4',0.1629000
amber,3,DI,O4',-0.3691000
amber,3,DI,C3',0.0713000
amber,3,DI,O3',-0.6549000
amber,3,DI,C2',-0.0854000
amber,3,DI,C1',0.0358000
amber,3,DI,N9,0.0577000
amber,3,DI,C8,0.0736000
amber,3,DI,N7,-0.5725000
amber,3,DI,C5,0.1991000
amber,3,DI,C6,0.4918000
amber,3,DI,O6,-0.5699000
amber,3,DI,N1,-0.5053000
amber,3,DI,C2,0.6074000
amber,3,DI,N3,-0.6636000
amber,3,DI,C4,0.1814000
amber,3,DI,H5',0.0754000
amber,3,DI,H5'',0.0754000
amber,3,DI,H4',0.1176000
amber,3,DI,H3',0.0985000
amber,3,DI,H2',0.0718000
amber,3,DI,H2'',0.0718000
amber,3,DI,H1',0.1746000
amber,3,DI,HO3',0.4396000
amber,3,DI,H8,0.1997000
amber,3,DI,H1,0.3520000
amber,3,DI,H2,0.0598000
charmm,m,DA,P,1.5000000
charmm,m,DA,OP1,-0.7800000
charmm,m,DA,OP2,-0.7800000
charmm,m,DA,O5',-0.5700000
charmm,m,DA,C5',-0.0800000
charmm,m,DA,C4',0.1600000
charmm,m,DA,O4',-0.5000000
charmm,m,DA,C3',0.0100000
charmm,m,DA,O3',-0.5700000
charmm,m,DA,C2',-0.1800000
charmm,m,DA,C1',0.1600000
charmm,m,DA,N9,-0.0500000
charmm,m,DA,C8,0.3400000
charmm,m,DA,N7,-0.7100000
charmm,m,DA,C5,0.2800000
charmm,m,DA,C6,0.4600000
charmm,m,DA,N6,-0.7700000
charmm,m,DA,N1,-0.7400000
charmm,m,DA,C2,0.5000000
charmm,m,DA,N3,-0.7500000
charmm,m,DA,C4,0.4300000
charmm,m,DA,H5',0.0900000
charmm,m,DA,H5'',0.0900000
charmm,m,DA,H4',0.0900000
charmm,m,DA,H3',0.0900000
charmm,m,DA,H2',0.0900000
charmm,m,DA,H2'',0.0900000
charmm,m,DA,H1',0.0900000
charmm,m,DA,H8,0.1200000
charmm,m,DA,H61,0.3800000
charmm,m,DA,H62,0.3800000
charmm,m,DA,H2,0.1300000
charmm,5,DA,O5',-0.6600000
charmm,5,DA,C5',0.0500000
charmm,5,DA,C4',0.1600000
charmm,5,DA,O4',-0.5000000
charmm,5,DA,C3',0.0100000
charmm,5,DA,O3',-0.5700000
charmm,5,DA,C2',-0.1800000
charmm,5,DA,C1',0.1600000
charmm,5,DA,N9,-0.0500000
charmm,5,DA,C8,0.3400000
charmm,5,DA,N7,-0.7100000
charmm,5,DA,C5,0.2800000
charmm,5,DA,C6,0.4600000
charmm,5,DA,N6,-0.7700000
charmm,5,DA,N1,-0.7400000
charmm,5,DA,C2,0.5000000
charmm,5,DA,N3,-0.7500000
charmm,5,DA,C4,0.4300000
charmm,5,DA,H5',0.0900000
charmm,5,DA,H5'',0.0900000
charmm,5,DA,H4',0.0900000
charmm,5,DA,H3',0.0900000
charmm,5,DA,H2',0.0900000
charmm,5,DA,H2'',0.0900000
charmm,5,DA,H1',0.0900000
charmm,5,DA,HO5',0.4300000
charmm,5,DA,H8,0.1200000
charmm,5,DA,H61,0.3800000
charmm,5,DA,H62,0.3800000
charmm,5,DA,H2,0.1300000
charmm,3,DA,P,1.5000000
charmm,3,DA,OP1,-0.7800000
charmm,3,DA,OP2,-0.7800000
charmm,3,DA,O5',-0.5700000
charmm,3,DA,C5',-0.0800000
charmm,3,DA,C4',0.1600000
charmm,3,DA,O4',-0.5000000
charmm,3,DA,C3',0.1400000
charmm,3,DA,O3',-0.6600000
charmm,3,DA,C2',-0.1800000
charmm,3,DA,C1',0.1600000
charmm,3,DA,N9,-0.0500000
charmm,3,DA,C8,0.3400000
charmm,3,DA,N7,-0.7100000
charmm,3,DA,C5,0.2800000
charmm,3,DA,C6,0.4600000
charmm,3,DA,N6,-0.7700000
charmm,3,DA,N1,-0.7400000
charmm,3,DA,C2,0.5000000
charmm,3,DA,N3,-0.7500000
charmm,3,DA,C4,0.4300000
charmm,3,DA,H5',0.0900000
charmm,3,DA,H5'',0.0900000
charmm,3,DA,H4',0.0900000
charmm,3,DA,H3',0.0900000
charmm,3,DA,H2',0.0900000
charmm,3,DA,H2'',0.0900000
charmm,3,DA,H1',0.0900000
charmm,3,DA,HO3',0.4300000
charmm,3,DA,H8,0.1200000
charmm,3,DA,H61,0.3800000
charmm,3,DA,H62,0.3800000
charmm,3,DA,H2,0.1300000
charmm,m,DT,P,1.5000000
charmm,m,DT,OP1,-0.7800000
charmm,m,DT,OP2,-0.7800000
charmm,m,DT,O5',-0.5700000
charmm,m,DT,C5',-0.0800000
charmm,m,DT,C4',0.1600000
charmm,m,DT,O4',-0.5000000
charmm,m,DT,C3',0.0100000
charmm,m,DT,O3',-0.5700000
charmm,m,DT,C2',-0.1800000
charmm,m,DT,C1',0.1600000
charmm,m,DT,N1,-0.3400000
charmm,m,DT,C2,0.5100000
charmm,m,DT,O2,-0.4100000
charmm,m,DT,N3,-0.4600000
charmm,m,DT,C4,0.5000000
charmm,m,DT,O4,-0.4500000
charmm,m,DT,C5,-0.1500000
charmm,m,DT,C7,-0.1100000
charmm,m,DT,C6,0.1700000
charmm,m,DT,H5',0.0900000
charmm,m,DT,H5'',0.0900000
charmm,m,DT,H4',0.0900000
charmm,m,DT,H3',0.0900000
charmm,m,DT,H2',0.0900000
charmm,m,DT,H2'',0.0900000
charmm,m,DT,H1',0.0900000
charmm,m,DT,H3,0.3600000
charmm,m,DT,H71,0.0700000
charmm,m,DT,H72,0.0700000
charmm,m,DT,H73,0.0700000
charmm,m,DT,H6,0.1700000
charmm,5,DT,O5',-0.6600000
charmm,5,DT,C5',0.0500000
charmm,5,DT,C4',0.1600000
charmm,5,DT,O4',-0.5000000
charmm,5,DT,C3',0.0100000
charmm,5,DT,O3',-0.5700000
charmm,5,DT,C2',-0.1800000
charmm,5,DT,C1',0.1600000
charmm,5,DT,N1,-0.3400000
charmm,5,DT,C2,0.5100000
charmm,5,DT,O2,-0.4100000
charmm,5,DT,N3,-0.4600000
charmm,5,DT,C4,0.5000000
charmm,5,DT,O4,-0.4500000
charmm,5,DT,C5,-0.1500000
charmm,5,DT,C7,-0.1100000
charmm,5,DT,C6,0.1700000
charmm,5,DT,H5',0.0900000
charmm,5,DT,H5'',0.0900000
charmm,5,DT,H4',0.0900000
charmm,5,DT,H3',0.0900000
charmm,5,DT,H2',0.0900000
charmm,5,DT,H2'',0.0900000
charmm,5,DT,H1',0.0900000
charmm,5,DT,HO5',0.4300000
charmm,5,DT,H3,0.3600000
charmm,5,DT,H71,0.0700000
charmm,5,DT,H72,0.0700000
charmm,5,DT,H73,0.0700000
charmm,5,DT,H6,0.1700000
charmm,3,DT,P,1.5000000
charmm,3,DT,OP1,-0.7800000
charmm,3,DT,OP2,-0.7800000
charmm,3,DT,O5',-0.5700000
charmm,3,DT,C5',-0.0800000
charmm,3,DT,C4',0.1600000
charmm,3,DT,O4',-0.5000000
charmm,3,DT,C3',0.1400000
charmm,3,DT,O3',-0.6600000
charmm,3,DT,C2',-0.1800000
charmm,3,DT,C1',0.1600000
charmm,3,DT,N1,-0.3400000
charmm,3,DT,C2,0.5100000
charmm,3,DT,O2,-0.4100000
charmm,3,DT,N3,-0.4600000
charmm,3,DT,C4,0.5000000
charmm,3,DT,O4,-0.4500000
charmm,3,DT,C5,-0.1500000
charmm,3,DT,C7,-0.1100000
charmm,3,DT,C6,0.1700000
charmm,3,DT,H5',0.0900000
charmm,3,DT,H5'',0.0900000
charmm,3,DT,H4',0.0900000
charmm,3,DT,H3',0.0900000
charmm,3,DT,H2',0.0900000
charmm,3,DT,H2'',0.0900000
charmm,3,DT,H1',0.0900000
charmm,3,DT,HO3',0.4300000
charmm,3,DT,H3,0.3600000
charmm,3,DT,H71,0.0700000
charmm,3,DT,H72,0.0700000
charmm,3,DT,H73,0.0700000
charmm,3,DT,H6,0.1700000
charmm,m,DG,P,1.5000000
charmm,m,DG,OP1,-0.7800000
charmm,m,DG,OP2,-0.7800000
charmm,m,DG,O5',-0.5700000
charmm,m,DG,C5',-0.0800000
charmm,m,DG,C4',0.1600000
charmm,m,DG,O4',-0.5000000
charmm,m,DG,C3',0.0100000
charmm,m,DG,O3',-0.5700000
charmm,m,DG,C2',-0.1800000
charmm,m,DG,C1',0.1600000
charmm,m,DG,N9,-0.0200000
charmm,m,DG,C8,0.2500000
charmm,m,DG,N7,-0.6000000
charmm,m,DG,C5,0.0000000
charmm,m,DG,C6,0.5400000
charmm,m,DG,O6,-0.5100000
charmm,m,DG,N1,-0.3400000
charmm,m,DG,C2,0.7500000
charmm,m,DG,N2,-0.6800000
charmm,m,DG,N3,-0.7400000
charmm,m,DG,C4,0.2600000
charmm,m,DG,H5',0.0900000
charmm,m,DG,H5'',0.0900000
charmm,m,DG,H4',0.0900000
charmm,m,DG,H3',0.0900000
charmm,m,DG,H2',0.0900000
charmm,m,DG,H2'',0.0900000
charmm,m,DG,H1',0.0900000
charmm,m,DG,H8,0.1600000
charmm,m,DG,H1,0.2600000
charmm,m,DG,H21,0.3200000
charmm,m,DG,H22,0.3500000
charmm,5,DG,O5',-0.6600000
charmm,5,DG,C5',0.0500000
charmm,5,DG,C4',0.1600000
charmm,5,DG,O4',-0.5000000
charmm,5,DG,C3',0.0100000
charmm,5,DG,O3',-0.5700000
charmm,5,DG,C2',-0.1800000
charmm,5,DG,C1',0.1600000
charmm,5,DG,N9,-0.0200000
charmm,5,DG,C8,0.2500000
charmm,5,DG,N7,-0.6000000
charmm,5,DG,C5,0.0000000
charmm,5,DG,C6,0.5400000
charmm,5,DG,O6,-0.5100000
charmm,5,DG,N1,-0.3400000
charmm,5,DG,C2,0.7500000
charmm,5,DG,N2,-0.6800000
charmm,5,DG,N3,-0.7400000
charmm,5,DG,C4,0.2600000
charmm,5,DG,H5',0.0900000
charmm,5,DG,H5'',0.0900000
charmm,5,DG,H4',0.0900000
charmm,5,DG,H3',0.0900000
charmm,5,DG,H2',0.0900000
charmm,5,DG,H2'',0.0900000
charmm,5,DG,H1',0.0900000
charmm,5,DG,HO5',0.4300000
charmm,5,DG,H8,0.1600000
charmm,5,DG,H1,0.2600000
charmm,5,DG,H21,0.3200000
charmm,5,DG,H22,0.3500000
charmm,3,DG,P,1.5000000
charmm,3,DG,OP1,-0.7800000
charmm,3,DG,OP2,-0.7800000
charmm,3,DG,O5',-0.5700000
charmm,3,DG,C5',-0.0800000
charmm,3,DG,C4',0.1600000
charmm,3,DG,O4',-0.5000000
charmm,3,DG,C3',0.1400000
charmm,3,DG,O3',-0.6600000
charmm,3,DG,C2',-0.1800000
charmm,3,DG,C1',0.1600000
charmm,3,DG,N9,-0.0200000
charmm,3,DG,C8,0.2500000
charmm,3,DG,N7,-0.6000000
charmm,3,DG,C5,0.0000000
charmm,3,DG,C6,0.5400000
charmm,3,DG,O6,-0.5100000
charmm,3,DG,N1,-0.3400000
charmm,3,DG,C2,0.7500000
charmm,3,DG,N2,-0.6800000
charmm,3,DG,N3,-0.7400000
charmm,3,DG,C4,0.2600000
charmm,3,DG,H5',0.0900000
charmm,3,DG,H5'',0.0900000
charmm,3,DG,H4',0.0900000
charmm,3,DG,H3',0.0900000
charmm,3,DG,H2',0.0900000
charmm,3,DG,H2'',0.0900000
charmm,3,DG,H1',0.0900000
charmm,3,DG,HO3',0.4300000
charmm,3,DG,H8,0.1600000
charmm,3,DG,H1,0.2600000
charmm,3,DG,H21,0.3200000
charmm,3,DG,H22,0.3500000
charmm,m,DC,P,1.5000000
charmm,m,DC,OP1,-0.7800000
charmm,m,DC,OP2,-0.7800000
charmm,m,DC,O5',-0.5700000
charmm,m,DC,C5',-0.0800000
charmm,m,DC,C4',0.1600000
charmm,m,DC,O4',-0.5000000
charmm,m,DC,C3',0.0100000
charmm,m,DC,O3',-0.5700000
charmm,m,DC,C2',-0.1800000
charmm,m,DC,C1',0.1600000
charmm,m,DC,N1,-0.1300000
charmm,m,DC,C2,0.5200000
charmm,m,DC,O2,-0.4900000
charmm,m,DC,N3,-0.6600000
charmm,m,DC,C4,0.6500000
charmm,m,DC,N4,-0.7500000
charmm,m,DC,C5,-0.1300000
charmm,m,DC,C6,0.0500000
charmm,m,DC,H5',0.0900000
charmm,m,DC,H5'',0.0900000
charmm,m,DC,H4',0.0900000
charmm,m,DC,H3',0.0900000
charmm,m,DC,H2',0.0900000
charmm,m,DC,H2'',0.0900000
charmm,m,DC,H1',0.0900000
charmm,m,DC,H41,0.3700000
charmm,m,DC,H42,0.3300000
charmm,m,DC,H5,0.0700000
charmm,m,DC,H6,0.1700000
charmm,5,DC,O5',-0.6600000
charmm,5,DC,C5',0.0500000
charmm,5,DC,C4',0.1600000
charmm,5,DC,O4',-0.5000000
charmm,5,DC,C3',0.0100000
charmm,5,DC,O3',-0.5700000
charmm,5,DC,C2',-0.1800000
charmm,5,DC,C1',0.1600000
charmm,5,DC,N1,-0.1300000
charmm,5,DC,C2,0.5200000
charmm,5,DC,O2,-0.4900000
charmm,5,DC,N3,-0.6600000
charmm,5,DC,C4,0.6500000
charmm,5,DC,N4,-0.7500000
charmm,5,DC,C5,-0.1300000
charmm,5,DC,C6,0.0500000
charmm,5,DC,H5',0.0900000
charmm,5,DC,H5'',0.0900000
charmm,5,DC,H4',0.0900000
charmm,5,DC,H3',0.0900000
charmm,5,DC,H2',0.0900000
charmm,5,DC,H2'',0.0900000
charmm,5,DC,H1',0.0900000
charmm,5,DC,HO5',0.4300000
charmm,5,DC,H41,0.3700000
charmm,5,DC,H42,0.3300000
charmm,5,DC,H5,0.0700000
charmm,5,DC,H6,0.1700000
charmm,3,DC,P,1.5000000
charmm,3,DC,OP1,-0.7800000
charmm,3,DC,OP2,-0.7800000
charmm,3,DC,O5',-0.5700000
charmm,3,DC,C5',-0.0800000
charmm,3,DC,C4',0.1600000
charmm,3,DC,O4',-0.5000000
charmm,3,DC,C3',0.1400000
charmm,3,DC,O3',-0.6600000
charmm,3,DC,C2',-0.1800000
charmm,3,DC,C1',0.1600000
charmm,3,DC,N1,-0.1300000
charmm,3,DC,C2,0.5200000
charmm,3,DC,O2,-0.4900000
charmm,3,DC,N3,-0.6600000
charmm,3,DC,C4,0.6500000
charmm,3,DC,N4,-0.7500000
charmm,3,DC,C5,-0.1300000
charmm,3,DC,C6,0.0500000
charmm,3,DC,H5',0.0900000
charmm,3,DC,H5'',0.0900000
charmm,3,DC,H4',0.0900000
charmm,3,DC,H3',0.0900000
charmm,3,DC,H2',0.0900000
charmm,3,DC,H2'',0.0900000
charmm,3,DC,H1',0.0900000
charmm,3,DC,HO3',0.4300000
charmm,3,DC,H41,0.3700000
charmm,3,DC,H42,0.3300000
charmm,3,DC,H5,0.0700000
charmm,3,DC,H6,0.1700000
charmm,m,DI,P,1.5000000
charmm,m,DI,OP1,-0.7800000
charmm,m,DI,OP2,-0.7800000
charmm,m,DI,O5',-0.5700000
charmm,m,DI,C5',-0.0800000
charmm,m,DI,C4',0.1600000
charmm,m,DI,O4',-0.5000000
charmm,m,DI,C3',0.0100000
charmm,m,DI,O3',-0.5700000
charmm,m,DI,C2',-0.1800000
charmm,m,DI,C1',0.1600000
charmm,m,DI,N9,-0.0100000
charmm,m,DI,C8,0.2600000
charmm,m,DI,N7,-0.6100000
charmm,m,DI,C5,0.0100000
charmm,m,DI,C6,0.5500000
charmm,m,DI,O6,-0.5100000
charmm,m,DI,N1,-0.3200000
charmm,m,DI,C2,0.5100000
charmm,m,DI,N3,-0.6400000
charmm,m,DI,C4,0.2600000
charmm,m,DI,H5',0.0900000
charmm,m,DI,H5'',0.0900000
charmm,m,DI,H4',0.0900000
charmm,m,DI,H3',0.0900000
charmm,m,DI,H2',0.0900000
charmm,m,DI,H2'',0.0900000
charmm,m,DI,H1',0.0900000
charmm,m,DI,H8,0.1500000
charmm,m,DI,H1,0.2500000
charmm,m,DI,H2,0.1000000
charmm,5,DI,O5',-0.6600000
charmm,5,DI,C5',0.0500000
charmm,5,DI,C4',0.1600000
charmm,5,DI,O4',-0.5000000
charmm,5,DI,C3',0.0100000
charmm,5,DI,O3',-0.5700000
charmm,5,DI,C2',-0.1800000
charmm,5,DI,C1',0.1600000
charmm,5,DI,N9,-0.0100000
charmm,5,DI,C8,0.2600000
charmm,5,DI,N7,-0.6100000
charmm,5,DI,C5,0.0100000
charmm,5,DI,C6,0.5500000
charmm,5,DI,O6,-0.5100000
charmm,5,DI,N1,-0.3200000
charmm,5,DI,C2,0.5100000
charmm,5,DI,N3,-0.6400000
charmm,5,DI,C4,0.2600000
charmm,5,DI,H5',0.0900000
charmm,5,DI,H5'',0.0900000
charmm,5,DI,H4',0.0900000
charmm,5,DI,H3',0.0900000
charmm,5,DI,H2',0.0900000
charmm,5,DI,H2'',0.0900000
charmm,5,DI,H1',0.0900000
charmm,5,DI,HO5',0.4300000
charmm,5,DI,H8,0.1500000
charmm,5,DI,H1,0.2500000
charmm,5,DI,H2,0.1000000
charmm,3,DI,P,1.5000000
charmm,3,DI,OP1,-0.7800000
charmm,3,DI,OP2,-0.7800000
charmm,3,DI,O5',-0.5700000
charmm,3,DI,C5',-0.0800000
charmm,3,DI,C4',0.1600000
charmm,3,DI,O4',-0.5000000
charmm,3,DI,C3',0.1400000
charmm,3,DI,O3',-0.6600000
charmm,3,DI,C2',-0.1800000
charmm,3,DI,C1',0.1600000
charmm,3,DI,N9,-0.0100000
charmm,3,DI,C8,0.2600000
charmm,3,DI,N7,-0.6100000
charmm,3,DI,C5,0.0100000
charmm,3,DI,C6,0.5500000
charmm,3,DI,O6,-0.5100000
charmm,3,DI,N1,-0.3200000
charmm,3,DI,C2,0.5100000
charmm,3,DI,N3,-0.6400000
charmm,3,DI,C4,0.2600000
charmm,3,DI,H5',0.0900000
charmm,3,DI,H5'',0.0900000
charmm,3,DI,H4',0.0900000
charmm,3,DI,H3',0.0900000
charmm,3,DI,H2',0.0900000
charmm,3,DI,H2'',0.0900000
charmm,3,DI,H1',0.0900000
charmm,3,DI,HO3',0.4300000
charmm,3,DI,H8,0.1500000
charmm,3,DI,H1,0.2500000
charmm,3,DI,H2,0.1000000
amber,m,A,P,1.1662000
amber,m,A,OP1,-0.7760000
amber,m,A,OP2,-0.7760000
amber,m,A,O5',-0.4989000
amber,m,A,C5',0.0558000
amber,m,A,C4',0.1065000
amber,m,A,O4',-0.3548000
amber,m,A,C3',0.2022000
amber,m,A,O3',-0.5246000
amber,m,A,C2',0.0670000
amber,m,A,O2',-0.6139000
amber,m,A,C1',0.0394000
amber,m,A,N9,-0.0251000
amber,m,A,C8,0.2006000
amber,m,A,N7,-0.6073000
amber,m,A,C5,0.0515000
amber,m,A,C6,0.7009000
amber,m,A,N6,-0.9019000
amber,m,A,N1,-0.7615000
amber,m,A,C2,0.5875000
amber,m,A,N3,-0.6997000
amber,m,A,C4,0.3053000
amber,m,A,H5',0.0679000
amber,m,A,H5'',0.0679000
amber,m,A,H4',0.1174000
amber,m,A,H3',0.0615000
amber,m,A,H2',0.0972000
amber,m,A,HO2',0.4186000
amber,m,A,H1',0.2007000
amber,m,A,H8,0.1553000
amber,m,A,H61,0.4115000
amber,m,A,H62,0.4115000
amber,m,A,H2,0.0473000
amber,5,A,O5',-0.6223000
amber,5,A,C5',0.0558000
amber,5,A,C4',0.1065000
amber,5,A,O4',-0.3548000
amber,5,A,C3',0.2022000
amber,5,A,O3',-0.5246000
amber,5,A,C2',0.0670000
amber,5,A,O2',-0.6139000
amber,5,A,C1',0.0394000
amber,5,A,N9,-0.0251000
amber,5,A,C8,0.2006000
amber,5,A,N7,-0.6073000
amber,5,A,C5,0.0515000
amber,5,A,C6,0.7009000
amber,5,A,N6,-0.9019000
amber,5,A,N1,-0.7615000
amber,5,A,C2,0.5875000
amber,5,A,N3,-0.6997000
amber,5,A,C4,0.3053000
amber,5,A,H5',0.0679000
amber,5,A,H5'',0.0679000
amber,5,A,H4',0.1174000
amber,5,A,H3',0.0615000
amber,5,A,H2',0.0972000
amber,5,A,HO2',0.4186000
amber,5,A,H1',0.2007000
amber,5,A,HO5',0.4295000
amber,5,A,H8,0.1553000
amber,5,A,H61,0.4115000
amber,5,A,H62,0.4115000
amber,5,A,H2,0.0473000
amber,3,A,P,1.1662000
amber,3,A,OP1,-0.7760000
amber,3,A,OP2,-0.7760000
amber,3,A,O5',-0.4989000
amber,3,A,C5',0.0558000
amber,3,A,C4',0.1065000
amber,3,A,O4',-0.3548000
amber,3,A,C3',0.2022000
amber,3,A,O3',-0.6541000
amber,3,A,C2',0.0670000
amber,3,A,O2',-0.6139000
amber,3,A,C1',0.0394000
amber,3,A,N9,-0.0251000
amber,3,A,C8,0.2006000
amber,3,A,N7,-0.6073000
amber,3,A,C5,0.0515000
amber,3,A,C6,0.7009000
amber,3,A,N6,-0.9019000
amber,3,A,N1,-0.7615000
amber,3,A,C2,0.5875000
amber,3,A,N3,-0.6997000
amber,3,A,C4,0.3053000
amber,3,A,H5',0.0679000
amber,3,A,H5'',0.0679000
amber,3,A,H4',0.1174000
amber,3,A,H3',0.0615000
amber,3,A,H2',0.0972000
amber,3,A,HO2',0.4186000
amber,3,A,H1',0.2007000
amber,3,A,HO3',0.4376000
amber,3,A,H8,0.1553000
amber,3,A,H61,0.4115000
amber,3,A,H62,0.4115000
amber,3,A,H2,0.0473000
amber,m,U,P,1.1662000
amber,m,U,OP1,-0.7760000
amber,m,U,OP2,-0.7760000
amber,m,U,O5',-0.4989000
amber,m,U,C5',0.0558000
amber,m,U,C4',0.1065000
amber,m,U,O4',-0.3548000
amber,m,U,C3',0.2022000
amber,m,U,O3',-0.5246000
amber,m,U,C2',0.0670000
amber,m,U,O2',-0.6139000
amber,m,U,C1',0.0674000
amber,m,U,N1,0.0418000
amber,m,U,C2,0.4687000
amber,m,U,O2,-0.5477000
amber,m,U,N3,-0.3549000
amber,m,U,C4,0.5952000
amber,m,U,O4,-0.5761000
amber,m,U,C5,-0.3635000
amber,m,U,C6,-0.1126000
amber,m,U,H5',0.0679000
amber,m,U,H5'',0.0679000
amber,m,U,H4',0.1174000
amber,m,U,H3',0.0615000
amber,m,U,H2',0.0972000
amber,m,U,HO2',0.4186000
amber,m,U,H1',0.1824000
amber,m,U,H3,0.3154000
amber,m,U,H5,0.1811000
amber,m,U,H6,0.2188000
amber,5,U,O5',-0.6223000
amber,5,U,C5',0.0558000
amber,5,U,C4',0.1065000
amber,5,U,O4',-0.3548000
amber,5,U,C3',0.2022000
amber,5,U,O3',-0.5246000
amber,5,U,C2',0.0670000
amber,5,U,O2',-0.6139000
amber,5,U,C1',0.0674000
amber,5,U,N1,0.0418000
amber,5,U,C2,0.4687000
amber,5,U,O2,-0.5477000
amber,5,U,N3,-0.3549000
amber,5,U,C4,0.5952000
amber,5,U,O4,-0.5761000
amber,5,U,C5,-0.3635000
amber,5,U,C6,-0.1126000
amber,5,U,H5',0.0679000
amber,5,U,H5'',0.0679000
amber,5,U,H4',0.1174000
amber,5,U,H3',0.0615000
amber,5,U,H2',0.0972000
amber,5,U,HO2',0.4186000
amber,5,U,H1',0.1824000
amber,5,U,HO5',0.4295000
amber,5,U,H3,0.3154000
amber,5,U,H5,0.1811000
amber,5,U,H6,0.2188000
amber,3,U,P,1.1662000
amber,3,U,OP1,-0.7760000
amber,3,U,OP2,-0.7760000
amber,3,U,O5',-0.4989000
amber,3,U,C5',0.0558000
amber,3,U,C4',0.1065000
amber,3,U,O4',-0.3548000
amber,3,U,C3',0.2022000
amber,3,U,O3',-0.6541000
amber,3,U,C2',0.0670000
amber,3,U,O2',-0.6139000
amber,3,U,C1',0.0674000
amber,3,U,N1,0.0418000
amber,3,U,C2,0.4687000
amber,3,U,O2,-0.5477000
amber,3,U,N3,-0.3549000
amber,3,U,C4,0.5952000
amber,3,U,O4,-0.5761000
amber,3,U,C5,-0.3635000
amber,3,U,C6,-0.1126000
amber,3,U,H5',0.0679000
amber,3,U,H5'',0.0679000
amber,3,U,H4',0.1174000
amber,3,U,H3',0.0615000
amber,3,U,H2',0.0972000
amber,3,U,HO2',0.4186000
amber,3,U,H1',0.1824000
amber,3,U,HO3',0.4376000
amber,3,U,H3,0.3154000
amber,3,U,H5,0.1811000
amber,3,U,H6,0.2188000
amber,m,G,P,1.1662000
amber,m,G,OP1,-0.7760000
amber,m,G,OP2,-0.7760000
amber,m,G,O5',-0.4989000
amber,m,G,C5',0.0558000
amber,m,G,C4',0.1065000
amber,m,G,O4',-0.3548000
amber,m,G,C3',0.2022000
amber,m,G,O3',-0.5246000
amber,m,G,C2',0.0670000
amber,m,G,O2',-0.6139000
amber,m,G,C1',0.0191000
amber,m,G,N9,0.0492000
amber,m,G,C8,0.1374000
amber,m,G,N7,-0.5709000
amber,m,G,C5,0.1744000
amber,m,G,C6,0.4770000
amber,m,G,O6,-0.5597000
amber,m,G,N1,-0.4787000
amber,m,G,C2,0.7657000
amber,m,G,N2,-0.9672000
amber,m,G,N3,-0.6323000
amber,m,G,C4,0.1222000
amber,m,G,H5',0.0679000
amber,m,G,H5'',0.0679000
amber,m,G,H4',0.1174000
amber,m,G,H3',0.0615000
amber,m,G,H2',0.0972000
amber,m,G,HO2',0.4186000
amber,m,G,H1',0.2006000
amber,m,G,H8,0.1640000
amber,m,G,H1,0.3424000
amber,m,G,H21,0.4364000
amber,m,G,H22,0.4364000
amber,5,G,O5',-0.6223000
amber,5,G,C5',0.0558000
amber,5,G,C4',0.1065000
amber,5,G,O4',-0.3548000
amber,5,G,C3',0.2022000
amber,5,G,O3',-0.5246000
amber,5,G,C2',0.0670000
amber,5,G,O2',-0.6139000
amber,5,G,C1',0.0191000
amber,5,G,N9,0.0492000
amber,5,G,C8,0.1374000
amber,5,G,N7,-0.5709000
amber,5,G,C5,0.1744000
amber,5,G,C6,0.4770000
amber,5,G,O6,-0.5597000
amber,5,G,N1,-0.4787000
amber,5,G,C2,0.7657000
amber,5,G,N2,-0.9672000
amber,5,G,N3,-0.6323000
amber,5,G,C4,0.1222000
amber,5,G,H5',0.0679000
amber,5,G,H5'',0.0679000
amber,5,G,H4',0.1174000
amber,5,G,H3',0.0615000
amber,5,G,H2',0.0972000
amber,5,G,HO2',0.4186000
amber,5,G,H1',0.2006000
amber,5,G,HO5',0.4295000
amber,5,G,H8,0.1640000
amber,5,G,H1,0.3424000
amber,5,G,H21,0.4364000
amber,5,G,H22,0.4364000
amber,3,G,P,1.1662000
amber,3,G,OP1,-0.7760000
amber,3,G,OP2,-0.7760000
amber,3,G,O5',-0.4989000
amber,3,G,C5',0.0558000
amber,3,G,C4',0.1065000
amber,3,G,O4',-0.3548000
amber,3,G,C3',0.2022000
amber,3,G,O3',-0.6541000
amber,3,G,C2',0.0670000
amber,3,G,O2',-0.6139000
amber,3,G,C1',0.0191000
amber,3,G,N9,0.0492000
amber,3,G,C8,0.1374000
amber,3,G,N7,-0.5709000
amber,3,G,C5,0.1744000
amber,3,G,C6,0.4770000
amber,3,G,O6,-0.5597000
amber,3,G,N1,-0.4787000
amber,3,G,C2,0.7657000
amber,3,G,N2,-0.9672000
amber,3,G,N3,-0.6323000
amber,3,G,C4,0.1222000
amber,3,G,H5',0.0679000
amber,3,G,H5'',0.0679000
amber,3,G,H4',0.1174000
amber,3,G,H3',0.0615000
amber,3,G,H2',0.0972000
amber,3,G,HO2',0.4186000
amber,3,G,H1',0.2006000
amber,3,G,HO3',0.4376000
amber,3,G,H8,0.1640000
amber,3,G,H1,0.3424000
amber,3,G,H21,0.4364000
amber,3,G,H22,0.4364000
amber,m,C,P,1.1662000
amber,m,C,OP1,-0.7760000
amber,m,C,OP2,-0.7760000
amber,m,C,O5',-0.4989000
amber,m,C,C5',0.0558000
amber,m,C,C4',0.1065000
amber,m,C,O4',-0.3548000
amber,m,C,C3',0.2022000
amber,m,C,O3',-0.5246000
amber,m,C,C2',0.0670000
amber,m,C,O2',-0.6139000
amber,m,C,C1',0.0066000
amber,m,C,N1,-0.0484000
amber,m,C,C2,0.7538000
amber,m,C,O2,-0.6252000
amber,m,C,N3,-0.7584000
amber,m,C,C4,0.8185000
amber,m,C,N4,-0.9530000
amber,m,C,C5,-0.5215000
amber,m,C,C6,0.0053000
amber,m,C,H5',0.0679000
amber,m,C,H5'',0.0679000
amber,m,C,H4',0.1174000
amber,m,C,H3',0.0615000
amber,m,C,H2',0.0972000
amber,m,C,HO2',0.4186000
amber,m,C,H1',0.2029000
amber,m,C,H41,0.4234000
amber,m,C,H42,0.4234000
amber,m,C,H5,0.1928000
amber,m,C,H6,0.1958000
amber,5,C,O5',-0.6223000
amber,5,C,C5',0.0558000
amber,5,C,C4',0.1065000
amber,5,C,O4',-0.3548000
amber,5,C,C3',0.2022000
amber,5,C,O3',-0.5246000
amber,5,C,C2',0.0670000
amber,5,C,O2',-0.6139000
amber,5,C,C1',0.0066000
amber,5,C,N1,-0.0484000
amber,5,C,C2,0.7538000
amber,5,C,O2,-0.6252000
amber,5,C,N3,-0.7584000
amber,5,C,C4,0.8185000
amber,5,C,N4,-0.9530000
amber,5,C,C5,-0.5215000
amber,5,C,C6,0.0053000
amber,5,C,H5',0.0679000
amber,5,C,H5'',0.0679000
amber,5,C,H4',0.1174000
amber,5,C,H3',0.0615000
amber,5,C,H2',0.0972000
amber,5,C,HO2',0.4186000
amber,5,C,H1',0.2029000
amber,5,C,HO5',0.4295000
amber,5,C,H41,0.4234000
amber,5,C,H42,0.4234000
amber,5,C,H5,0.1928000
amber,5,C,H6,0.1958000
amber,3,C,P,1.1662000
amber,3,C,OP1,-0.7760000
amber,3,C,OP2,-0.7760000
amber,3,C,O5',-0.4989000
amber,3,C,C5',0.0558000
amber,3,C,C4',0.1065000
amber,3,C,O4',-0.3548000
amber,3,C,C3',0.2022000
amber,3,C,O3',-0.6541000
amber,3,C,C2',0.0670000
amber,3,C,O2',-0.6139000
amber,3,C,C1',0.0066000
amber,3,C,N1,-0.0484000
amber,3,C,C2,0.7538000
amber,3,C,O2,-0.6252000
amber,3,C,N3,-0.7584000
amber,3,C,C4,0.8185000
amber,3,C,N4,-0.9530000
amber,3,C,C5,-0.5215000
amber,3,C,C6,0.0053000
amber,3,C,H5',0.0679000
amber,3,C,H5'',0.0679000
amber,3,C,H4',0.1174000
amber,3,C,H3',0.0615000
amber,3,C,H2',0.0972000
amber,3,C,HO2',0.4186000
amber,3,C,H1',0.2029000
amber,3,C,HO3',0.4376000
amber,3,C,H41,0.4234000
amber,3,C,H42,0.4234000
amber,3,C,H5,0.1928000
amber,3,C,H6,0.1958000
amber,m,I,P,1.1662000
amber,m,I,OP1,-0.7760000
amber,m,I,OP2,-0.7760000
amber,m,I,O5',-0.4989000
amber,m,I,C5',0.0558000
amber,m,I,C4',0.1065000
amber,m,I,O4',-0.3548000
amber,m,I,C3',0.2022000
amber,m,I,O3',-0.5246000
amber,m,I,C2',0.0670000
amber,m,I,O2',-0.6139000
amber,m,I,C1',0.0191000
amber,m,I,N9,0.0492000
amber,m,I,C8,0.1374000
amber,m,I,N7,-0.5709000
amber,m,I,C5,0.1744000
amber,m,I,C6,0.4770000
amber,m,I,O6,-0.5597000
amber,m,I,N1,-0.4787000
amber,m,I,C2,0.6240000
amber,m,I,N3,-0.6323000
amber,m,I,C4,0.1222000
amber,m,I,H5',0.0679000
amber,m,I,H5'',0.0679000
amber,m,I,H4',0.1174000
amber,m,I,H3',0.0615000
amber,m,I,H2',0.0972000
amber,m,I,HO2',0.4186000
amber,m,I,H1',0.2006000
amber,m,I,H8,0.1640000
amber,m,I,H1,0.3424000
amber,m,I,H2,0.0473000
amber,5,I,O5',-0.6223000
amber,5,I,C5',0.0558000
amber,5,I,C4',0.1065000
amber,5,I,O4',-0.3548000
amber,5,I,C3',0.2022000
amber,5,I,O3',-0.5246000
amber,5,I,C2',0.0670000
amber,5,I,O2',-0.6139000
amber,5,I,C1',0.0191000
amber,5,I,N9,0.0492000
amber,5,I,C8,0.1374000
amber,5,I,N7,-0.5709000
amber,5,I,C5,0.1744000
amber,5,I,C6,0.4770000
amber,5,I,O6,-0.5597000
amber,5,I,N1,-0.4787000
amber,5,I,C2,0.6240000
amber,5,I,N3,-0.6323000
amber,5,I,C4,0.1222000
amber,5,I,H5',0.0679000
amber,5,I,H5'',0.0679000
amber,5,I,H4',0.1174000
amber,5,I,H3',0.0615000
amber,5,I,H2',0.0972000
amber,5,I,HO2',0.4186000
amber,5,I,H1',0.2006000
amber,5,I,HO5',0.4295000
amber,5,I,H8,0.1640000
amber,5,I,H1,0.3424000
amber,5,I,H2,0.0473000
amber,3,I,P,1.1662000
amber,3,I,OP1,-0.7760000
amber,3,I,OP2,-0.7760000
amber,3,I,O5',-0.4989000
amber,3,I,C5',0.0558000
amber,3,I,C4',0.1065000
amber,3,I,O4',-0.3548000
amber,3,I,C3',0.2022000
amber,3,I,O3',-0.6541000
amber,3,I,C2',0.0670000
amber,3,I,O2',-0.6139000
amber,3,I,C1',0.0191000
amber,3,I,N9,0.0492000
amber,3,I,C8,0.1374000
amber,3,I,N7,-0.5709000
amber,3,I,C5,0.1744000
amber,3,I,C6,0.4770000
amber,3,I,O6,-0.5597000
amber,3,I,N1,-0.4787000
amber,3,I,C2,0.6240000
amber,3,I,N3,-0.6323000
amber,3,I,C4,0.1222000
amber,3,I,H5',0.0679000
amber,3,I,H5'',0.0679000
amber,3,I,H4',0.1174000
amber,3,I,H3',0.0615000
amber,3,I,H2',0.0972000
amber,3,I,HO2',0.4186000
amber,3,I,H1',0.2006000
amber,3,I,HO3',0.4376000
amber,3,I,H8,0.1640000
amber,3,I,H1,0.3424000
amber,3,I,H2,0.0473000
charmm,m,A,P,1.5000000
charmm,m,A,OP1,-0.7800000
charmm,m,A,OP2,-0.7800000
charmm,m,A,O5',-0.5700000
charmm,m,A,C5',-0.0800000
charmm,m,A,C4',0.1600000
charmm,m,A,O4',-0.5000000
charmm,m,A,C3',0.0100000
charmm,m,A,O3',-0.5700000
charmm,m,A,C2',0.1400000
charmm,m,A,O2',-0.6600000
charmm,m,A,C1',0.1600000
charmm,m,A,N9,-0.0500000
charmm,m,A,C8,0.3400000
charmm,m,A,N7,-0.7100000
charmm,m,A,C5,0.2800000
charmm,m,A,C6,0.4600000
charmm,m,A,N6,-0.7700000
charmm,m,A,N1,-0.7400000
charmm,m,A,C2,0.5000000
charmm,m,A,N3,-0.7500000
charmm,m,A,C4,0.4300000
charmm,m,A,H5',0.0900000
charmm,m,A,H5'',0.0900000
charmm,m,A,H4',0.0900000
charmm,m,A,H3',0.0900000
charmm,m,A,H2',0.0900000
charmm,m,A,HO2',0.4300000
charmm,m,A,H1',0.0900000
charmm,m,A,H8,0.1200000
charmm,m,A,H61,0.3800000
charmm,m,A,H62,0.3800000
charmm,m,A,H2,0.1300000
charmm,5,A,O5',-0.6600000
charmm,5,A,C5',0.0500000
charmm,5,A,C4',0.1600000
charmm,5,A,O4',-0.5000000
charmm,5,A,C3',0.0100000
charmm,5,A,O3',-0.5700000
charmm,5,A,C2',0.1400000
charmm,5,A,O2',-0.6600000
charmm,5,A,C1',0.1600000
charmm,5,A,N9,-0.0500000
charmm,5,A,C8,0.3400000
charmm,5,A,N7,-0.7100000
charmm,5,A,C5,0.2800000
charmm,5,A,C6,0.4600000
charmm,5,A,N6,-0.7700000
charmm,5,A,N1,-0.7400000
charmm,5,A,C2,0.5000000
charmm,5,A,N3,-0.7500000
charmm,5,A,C4,0.4300000
charmm,5,A,H5',0.0900000
charmm,5,A,H5'',0.0900000
charmm,5,A,H4',0.0900000
charmm,5,A,H3',0.0900000
charmm,5,A,H2',0.0900000
charmm,5,A,HO2',0.4300000
charmm,5,A,H1',0.0900000
charmm,5,A,HO5',0.4300000
charmm,5,A,H8,0.1200000
charmm,5,A,H61,0.3800000
charmm,5,A,H62,0.3800000
charmm,5,A,H2,0.1300000
charmm,3,A,P,1.5000000
charmm,3,A,OP1,-0.7800000
charmm,3,A,OP2,-0.7800000
charmm,3,A,O5',-0.5700000
charmm,3,A,C5',-0.0800000
charmm,3,A,C4',0.1600000
charmm,3,A,O4',-0.5000000
charmm,3,A,C3',0.1400000
charmm,3,A,O3',-0.6600000
charmm,3,A,C2',0.1400000
charmm,3,A,O2',-0.6600000
charmm,3,A,C1',0.1600000
charmm,3,A,N9,-0.0500000
charmm,3,A,C8,0.3400000
charmm,3,A,N7,-0.7100000
charmm,3,A,C5,0.2800000
charmm,3,A,C6,0.4600000
charmm,3,A,N6,-0.7700000
charmm,3,A,N1,-0.7400000
charmm,3,A,C2,0.5000000
charmm,3,A,N3,-0.7500000
charmm,3,A,C4,0.4300000
charmm,3,A,H5',0.0900000
charmm,3,A,H5'',0.0900000
charmm,3,A,H4',0.0900000
charmm,3,A,H3',0.0900000
charmm,3,A,H2',0.0900000
charmm,3,A,HO2',0.4300000
charmm,3,A,H1',0.0900000
charmm,3,A,HO3',0.4300000
charmm,3,A,H8,0.1200000
charmm,3,A,H61,0.3800000
charmm,3,A,H62,0.3800000
charmm,3,A,H2,0.1300000
charmm,m,U,P,1.5000000
charmm,m,U,OP1,-0.7800000
charmm,m,U,OP2,-0.7800000
charmm,m,U,O5',-0.5700000
charmm,m,U,C5',-0.0800000
charmm,m,U,C4',0.1600000
charmm,m,U,O4',-0.5000000
charmm,m,U,C3',0.0100000
charmm,m,U,O3',-0.5700000
charmm,m,U,C2',0.1400000
charmm,m,U,O2',-0.6600000
charmm,m,U,C1',0.1600000
charmm,m,U,N1,-0.3400000
charmm,m,U,C2,0.5500000
charmm,m,U,O2,-0.4500000
charmm,m,U,N3,-0.4600000
charmm,m,U,C4,0.5300000
charmm,m,U,O4,-0.4800000
charmm,m,U,C5,-0.1500000
charmm,m,U,C6,0.2000000
charmm,m,U,H5',0.0900000
charmm,m,U,H5'',0.0900000
charmm,m,U,H4',0.0900000
charmm,m,U,H3',0.0900000
charmm,m,U,H2',0.0900000
charmm,m,U,HO2',0.4300000
charmm,m,U,H1',0.0900000
charmm,m,U,H3,0.3600000
charmm,m,U,H5,0.1000000
charmm,m,U,H6,0.1400000
charmm,5,U,O5',-0.6600000
charmm,5,U,C5',0.0500000
charmm,5,U,C4',0.1600000
charmm,5,U,O4',-0.5000000
charmm,5,U,C3',0.0100000
charmm,5,U,O3',-0.5700000
charmm,5,U,C2',0.1400000
charmm,5,U,O2',-0.6600000
charmm,5,U,C1',0.1600000
charmm,5,U,N1,-0.3400000
charmm,5,U,C2,0.5500000
charmm,5,U,O2,-0.4500000
charmm,5,U,N3,-0.4600000
charmm,5,U,C4,0.5300000
charmm,5,U,O4,-0.4800000
charmm,5,U,C5,-0.1500000
charmm,5,U,C6,0.2000000
charmm,5,U,H5',0.0900000
charmm,5,U,H5'',0.0900000
charmm,5,U,H4',0.0900000
charmm,5,U,H3',0.0900000
charmm,5,U,H2',0.0900000
charmm,5,U,HO2',0.4300000
charmm,5,U,H1',0.0900000
charmm,5,U,HO5',0.4300000
charmm,5,U,H3,0.3600000
charmm,5,U,H5,0.1000000
charmm,5,U,H6,0.1400000
charmm,3,U,P,1.5000000
charmm,3,U,OP1,-0.7800000
charmm,3,U,OP2,-0.7800000
charmm,3,U,O5',-0.5700000
charmm,3,U,C5',-0.0800000
charmm,3,U,C4',0.1600000
charmm,3,U,O4',-0.5000000
charmm,3,U,C3',0.1400000
charmm,3,U,O3',-0.6600000
charmm,3,U,C2',0.1400000
charmm,3,U,O2',-0.6600000
charmm,3,U,C1',0.1600000
charmm,3,U,N1,-0.3400000
charmm,3,U,C2,0.5500000
charmm,3,U,O2,-0.4500000
charmm,3,U,N3,-0.4600000
charmm,3,U,C4,0.5300000
charmm,3,U,O4,-0.4800000
charmm,3,U,C5,-0.1500000
charmm,3,U,C6,0.2000000
charmm,3,U,H5',0.0900000
charmm,3,U,H5'',0.0900000
charmm,3,U,H4',0.0900000
charmm,3,U,H3',0.0900000
charmm,3,U,H2',0.0900000
charmm,3,U,HO2',0.4300000
charmm,3,U,H1',0.0900000
charmm,3,U,HO3',0.4300000
charmm,3,U,H3,0.3600000
charmm,3,U,H5,0.1000000
charmm,3,U,H6,0.1400000
charmm,m,G,P,1.5000000
charmm,m,G,OP1,-0.7800000
charmm,m,G,OP2,-0.7800000
charmm,m,G,O5',-0.5700000
charmm,m,G,C5',-0.0800000
charmm,m,G,C4',0.1600000
charmm,m,G,O4',-0.5000000
charmm,m,G,C3',0.0100000
charmm,m,G,O3',-0.5700000
charmm,m,G,C2',0.1400000
charmm,m,G,O2',-0.6600000
charmm,m,G,C1',0.1600000
charmm,m,G,N9,-0.0200000
charmm,m,G,C8,0.2500000
charmm,m,G,N7,-0.6000000
charmm,m,G,C5,0.0000000
charmm,m,G,C6,0.5400000
charmm,m,G,O6,-0.5100000
charmm,m,G,N1,-0.3400000
charmm,m,G,C2,0.7500000
charmm,m,G,N2,-0.6800000
charmm,m,G,N3,-0.7400000
charmm,m,G,C4,0.2600000
charmm,m,G,H5',0.0900000
charmm,m,G,H5'',0.0900000
charmm,m,G,H4',0.0900000
charmm,m,G,H3',0.0900000
charmm,m,G,H2',0.0900000
charmm,m,G,HO2',0.4300000
charmm,m,G,H1',0.0900000
charmm,m,G,H8,0.1600000
charmm,m,G,H1,0.2600000
charmm,m,G,H21,0.3200000
charmm,m,G,H22,0.3500000
charmm,5,G,O5',-0.6600000
charmm,5,G,C5',0.0500000
charmm,5,G,C4',0.1600000
charmm,5,G,O4',-0.5000000
charmm,5,G,C3',0.0100000
charmm,5,G,O3',-0.5700000
charmm,5,G,C2',0.1400000
charmm,5,G,O2',-0.6600000
charmm,5,G,C1',0.1600000
charmm,5,G,N9,-0.0200000
charmm,5,G,C8,0.2500000
charmm,5,G,N7,-0.6000000
charmm,5,G,C5,0.0000000
charmm,5,G,C6,0.5400000
charmm,5,G,O6,-0.5100000
charmm,5,G,N1,-0.3400000
charmm,5,G,C2,0.7500000
charmm,5,G,N2,-0.6800000
charmm,5,G,N3,-0.7400000
charmm,5,G,C4,0.2600000
charmm,5,G,H5',0.0900000
charmm,5,G,H5'',0.0900000
charmm,5,G,H4',0.0900000
charmm,5,G,H3',0.0900000
charmm,5,G,H2',0.0900000
charmm,5,G,HO2',0.4300000
charmm,5,G,H1',0.0900000
charmm,5,G,HO5',0.4300000
charmm,5,G,H8,0.1600000
charmm,5,G,H1,0.2600000
charmm,5,G,H21,0.3200000
charmm,5,G,H22,0.3500000
charmm,3,G,P,1.5000000
charmm,3,G,OP1,-0.7800000
charmm,3,G,OP2,-0.7800000
charmm,3,G,O5',-0.5700000
charmm,3,G,C5',-0.0800000
charmm,3,G,C4',0.1600000
charmm,3,G,O4',-0.5000000
charmm,3,G,C3',0.1400000
charmm,3,G,O3',-0.6600000
charmm,3,G,C2',0.1400000
charmm,3,G,O2',-0.6600000
charmm,3,G,C1',0.1600000
charmm,3,G,N9,-0.0200000
charmm,3,G,C8,0.2500000
charmm,3,G,N7,-0.6000000
charmm,3,G,C5,0.0000000
charmm,3,G,C6,0.5400000
charmm,3,G,O6,-0.5100000
charmm,3,G,N1,-0.3400000
charmm,3,G,C2,0.7500000
charmm,3,G,N2,-0.6800000
charmm,3,G,N3,-0.7400000
charmm,3,G,C4,0.2600000
charmm,3,G,H5',0.0900000
charmm,3,G,H5'',0.0900000
charmm,3,G,H4',0.0900000
charmm,3,G,H3',0.0900000
charmm,3,G,H2',0.0900000
charmm,3,G,HO2',0.4300000
charmm,3,G,H1',0.0900000
charmm,3,G,HO3',0.4300000
charmm,3,G,H8,0.1600000
charmm,3,G,H1,0.2600000
charmm,3,G,H21,0.3200000
charmm,3,G,H22,0.3500000
charmm,m,C,P,1.5000000
charmm,m,C,OP1,-0.7800000
charmm,m,C,OP2,-0.7800000
charmm,m,C,O5',-0.5700000
charmm,m,C,C5',-0.0800000
charmm,m,C,C4',0.1600000
charmm,m,C,O4',-0.5000000
charmm,m,C,C3',0.0100000
charmm,m,C,O3',-0.5700000
charmm,m,C,C2',0.1400000
charmm,m,C,O2',-0.6600000
charmm,m,C,C1',0.1600000
charmm,m,C,N1,-0.1300000
charmm,m,C,C2,0.5200000
charmm,m,C,O2,-0.4900000
charmm,m,C,N3,-0.6600000
charmm,m,C,C4,0.6500000
charmm,m,C,N4,-0.7500000
charmm,m,C,C5,-0.1300000
charmm,m,C,C6,0.0500000
charmm,m,C,H5',0.0900000
charmm,m,C,H5'',0.0900000
charmm,m,C,H4',0.0900000
charmm,m,C,H3',0.0900000
charmm,m,C,H2',0.0900000
charmm,m,C,HO2',0.4300000
charmm,m,C,H1',0.0900000
charmm,m,C,H41,0.3700000
charmm,m,C,H42,0.3300000
charmm,m,C,H5,0.0700000
charmm,m,C,H6,0.1700000
charmm,5,C,O5',-0.6600000
charmm,5,C,C5',0.0500000
charmm,5,C,C4',0.1600000
charmm,5,C,O4',-0.5000000
charmm,5,C,C3',0.0100000
charmm,5,C,O3',-0.5700000
charmm,5,C,C2',0.1400000
charmm,5,C,O2',-0.6600000
charmm,5,C,C1',0.1600000
charmm,5,C,N1,-0.1300000
charmm,5,C,C2,0.5200000
charmm,5,C,O2,-0.4900000
charmm,5,C,N3,-0.6600000
charmm,5,C,C4,0.6500000
charmm,5,C,N4,-0.7500000
charmm,5,C,C5,-0.1300000
charmm,5,C,C6,0.0500000
charmm,5,C,H5',0.0900000
charmm,5,C,H5'',0.0900000
charmm,5,C,H4',0.0900000
charmm,5,C,H3',0.0900000
charmm,5,C,H2',0.0900000
charmm,5,C,HO2',0.4300000
charmm,5,C,H1',0.0900000
charmm,5,C,HO5',0.4300000
charmm,5,C,H41,0.3700000
charmm,5,C,H42,0.3300000
charmm,5,C,H5,0.0700000
charmm,5,C,H6,0.1700000
charmm,3,C,P,1.5000000
charmm,3,C,OP1,-0.7800000
charmm,3,C,OP2,-0.7800000
charmm,3,C,O5',-0.5700000
charmm,3,C,C5',-0.0800000
charmm,3,C,C4',0.1600000
charmm,3,C,O4',-0.5000000
charmm,3,C,C3',0.1400000
charmm,3,C,O3',-0.6600000
charmm,3,C,C2',0.1400000
charmm,3,C,O2',-0.6600000
charmm,3,C,C1',0.1600000
charmm,3,C,N1,-0.1300000
charmm,3,C,C2,0.5200000
charmm,3,C,O2,-0.4900000
charmm,3,C,N3,-0.6600000
charmm,3,C,C4,0.6500000
charmm,3,C,N4,-0.7500000
charmm,3,C,C5,-0.1300000
charmm,3,C,C6,0.0500000
charmm,3,C,H5',0.0900000
charmm,3,C,H5'',0.0900000
charmm,3,C,H4',0.0900000
charmm,3,C,H3',0.0900000
charmm,3,C,H2',0.0900000
charmm,3,C,HO2',0.4300000
charmm,3,C,H1',0.0900000
charmm,3,C,HO3',0.4300000
charmm,3,C,H41,0.3700000
charmm,3,C,H42,0.3300000
charmm,3,C,H5,0.0700000
charmm,3,C,H6,0.1700000
charmm,m,I,P,1.5000000
charmm,m,I,OP1,-0.7800000
charmm,m,I,OP2,-0.7800000
charmm,m,I,O5',-0.5700000
charmm,m,I,C5',-0.0800000
charmm,m,I,C4',0.1600000
charmm,m,I,O4',-0.5000000
charmm,m,I,C3',0.0100000
charmm,m,I,O3',-0.5700000
charmm,m,I,C2',0.1400000
charmm,m,I,O2',-0.6600000
charmm,m,I,C1',0.1600000
charmm,m,I,N9,-0.0100000
charmm,m,I,C8,0.2600000
charmm,m,I,N7,-0.6100000
charmm,m,I,C5,0.0100000
charmm,m,I,C6,0.5500000
charmm,m,I,O6,-0.5100000
charmm,m,I,N1,-0.3200000
charmm,m,I,C2,0.5100000
charmm,m,I,N3,-0.6400000
charmm,m,I,C4,0.2600000
charmm,m,I,H5',0.0900000
charmm,m,I,H5'',0.0900000
charmm,m,I,H4',0.0900000
charmm,m,I,H3',0.0900000
charmm,m,I,H2',0.0900000
charmm,m,I,HO2',0.4300000
charmm,m,I,H1',0.0900000
charmm,m,I,H8,0.1500000
charmm,m,I,H1,0.2500000
charmm,m,I,H2,0.1000000
charmm,5,I,O5',-0.6600000
charmm,5,I,C5',0.0500000
charmm,5,I,C4',0.1600000
charmm,5,I,O4',-0.5000000
charmm,5,I,C3',0.0100000
charmm,5,I,O3',-0.5700000
charmm,5,I,C2',0.1400000
charmm,5,I,O2',-0.6600000
charmm,5,I,C1',0.1600000
charmm,5,I,N9,-0.0100000
charmm,5,I,C8,0.2600000
charmm,5,I,N7,-0.6100000
charmm,5,I,C5,0.0100000
charmm,5,I,C6,0.5500000
charmm,5,I,O6,-0.5100000
charmm,5,I,N1,-0.3200000
charmm,5,I,C2,0.5100000
charmm,5,I,N3,-0.6400000
charmm,5,I,C4,0.2600000
charmm,5,I,H5',0.0900000
charmm,5,I,H5'',0.0900000
charmm,5,I,H4',0.0900000
charmm,5,I,H3',0.0900000
charmm,5,I,H2',0.0900000
charmm,5,I,HO2',0.4300000
charmm,5,I,H1',0.0900000
charmm,5,I,HO5',0.4300000
charmm,5,I,H8,0.1500000
charmm,5,I,H1,0.2500000
charmm,5,I,H2,0.1000000
charmm,3,I,P,1.5000000
charmm,3,I,OP1,-0.7800000
charmm,3,I,OP2,-0.7800000
charmm,3,I,O5',-0.5700000
charmm,3,I,C5',-0.0800000
charmm,3,I,C4',0.1600000
charmm,3,I,O4',-0.5000000
charmm,3,I,C3',0.1400000
charmm,3,I,O3',-0.6600000
charmm,3,I,C2',0.1400000
charmm,3,I,O2',-0.6600000
charmm,3,I,C1',0.1600000
charmm,3,I,N9,-0.0100000
charmm,3,I,C8,0.2600000
charmm,3,I,N7,-0.6100000
charmm,3,I,C5,0.0100000
charmm,3,I,C6,0.5500000
charmm,3,I,O6,-0.5100000
charmm,3,I,N1,-0.3200000
charmm,3,I,C2,0.5100000
charmm,3,I,N3,-0.6400000
charmm,3,I,C4,0.2600000
charmm,3,I,H5',0.0900000
charmm,3,I,H5'',0.0900000
charmm,3,I,H4',0.0900000
charmm,3,I,H3',0.0900000
charmm,3,I,H2',0.0900000
charmm,3,I,HO2',0.4300000
charmm,3,I,H1',0.0900000
charmm,3,I,HO3',0.4300000
charmm,3,I,H8,0.1500000
charmm,3,I,H1,0.2500000
charmm,3,I,H2,0.1000000
tip3p,,HOH,O,-0.8340000
tip3p,,HOH,H1,0.4170000
tip3p,,HOH,H2,0.4170000
tip3p-fb,,HOH,O,-0.848448690103
tip3p-fb,,HOH,H1,0.4242243450515
tip3p-fb,,HOH,H2,0.4242243450515
spc,,HOH,O,-0.8200000
spc,,HOH,H1,0.4100000
spc,,HOH,H2,0.4100000
spc-e,,HOH,O,-0.8476000
spc-e,,HOH,H1,0.4238000
spc-e,,HOH,H2,0.4238000
opc3,,HOH,O,-0.8951700
opc3,,HOH,H1,0.4475850
opc3,,HOH,H2,0.4475850
classic,,LI,LI,1.0000000
classic,,NA,NA,1.0000000
classic,,K,K,1.0000000
classic,,RB,RB,1.0000000
classic,,CS,CS,1.0000000
classic,,AG,AG,1.0000000
classic,,AU,AU,1.0000000
classic,,CU1,CU,1.0000000
classic,,TL,TL,1.0000000
classic,,MG,MG,2.0000000
classic,,CA,CA,2.0000000
classic,,SR,SR,2.0000000
classic,,BA,BA,2.0000000
classic,,MN,MN,2.0000000
classic,,FE2,FE,2.0000000
classic,,CO,CO,2.0000000
classic,,NI,NI,2.0000000
classic,,CU,CU,2.0000000
classic,,ZN,ZN,2.0000000
classic,,PD,PD,2.0000000
classic,,PT,PT,2.0000000
classic,,CD,CD,2.0000000
classic,,HG,HG,2.0000000
classic,,PB,PB,2.0000000
classic,,EU,EU,2.0000000
classic,,AL,AL,3.0000000
classic,,GA,GA,3.0000000
classic,,IN,IN,3.0000000
classic,,SB,SB,3.0000000
classic,,V,V,3.0000000
classic,,CR,CR,3.0000000
classic,,MN3,MN,3.0000000
classic,,FE,FE,3.0000000
classic,,3CO,CO,3.0000000
classic,,3NI,NI,3.0000000
classic,,RU,RU,3.0000000
classic,,RH3,RH,3.0000000
classic,,OS,OS,3.0000000
classic,,IR3,IR,3.0000000
classic,,AU3,AU,3.0000000
classic,,LA,LA,3.0000000
classic,,CE,CE,3.0000000
classic,,PR,PR,3.0000000
classic,,ND,ND,3.0000000
classic,,SM,SM,3.0000000
classic,,EU3,EU,3.0000000
classic,,GD3,GD,3.0000000
classic,,TB,TB,3.0000000
classic,,DY,DY,3.0000000
classic,,HO3,HO,3.0000000
classic,,ER3,ER,3.0000000
classic,,LU,LU,3.0000000
classic,,YB,YB,3.0000000
classic,,YT3,Y,3.0000000
classic,,ZR,ZR,4.0000000
classic,,PT4,PT,4.0000000
classic,,IR,IR,4.0000000
classic,,OS4,OS,4.0000000
classic,,TH,TH,4.0000000
classic,,4MO,MO,4.0000000
classic,,W,W,6.0000000
classic,,6MO,MO,6.0000000
classic,,F,F,-1.0000000
classic,,CL,CL,-1.0000000
classic,,BR,BR,-1.0000000
classic,,IOD,I,-1.0000000