AMBER FF94 and FF99 NADH Params MASS NE 14.01 NF 14.01 OE 16.00 CE 12.01 CF 12.01 CG 12.01 CH 12.01 HE 1.008 HF 1.008 HG 1.008 BOND NE-CE 302.0 1.480 NE-HE 434.0 1.010 NF-CG 420.0 1.320 OE-CE 860.0 1.230 CE-CF 302.0 1.480 CF-CH 225.0 1.490 CF-CG 420.0 1.320 CF-HF 374.0 1.090 CG-HF 374.0 1.090 CH-HG 340.0 1.090 CT-NF 337.0 1.475 ANGL HE-NE-HE 35.0 120.0 HE-NE-CE 35.0 120.0 NE-CE-OE 85.0 128.5 NE-CE-CF 85.0 113.0 CE-CF-CG 5.0 107.8 CE-CF-CH 125.0 124.2 OE-CE-CF 85.0 118.5 CF-CH-CF 125.0 108.0 CF-CH-HG 55.0 110.1 CF-CG-HF 42.0 119.0 CF-CG-NF 60.0 122.0 CH-CF-CG 43.5 128.0 CH-CF-HF 30.0 116.0 CG-NF-CG 20.0 114.0 HF-CG-NF 42.0 119.0 CG-CF-HF 42.0 116.0 HG-CH-HG 35.0 109.5 NF-CT-H2 50.0 109.5 CT-NF-CG 70.0 121.20 CT-CT-NF 50.0 109.5 OS-CT-NF 50.0 109.5 DIHE HE-NE-CE-OE 1 2.50 180.0 2. NE-CE-CF-CG 1 1.10 180.0 1. NE-CE-CF-CG 1 1.95 180.0 2. NE-CE-CF-CH 1 0.50 180.0 2. NE-CE-CF-CH 1 0.35 180.0 3. NE-CE-CF-CH 1 0.40 0.0 6. OE-CE-CF-CG 1 0.30 0.0 1. OE-CE-CF-CG 1 1.95 180.0 2. OE-CE-CF-CH 1 1.00 180.0 2. OE-CE-CF-CH 1 1.00 0.0 3. OE-CE-CF-CH 1 0.40 0.0 6. CE-CF-CG-HF 1 0.10 180.0 2. CE-CF-CG-NF 1 2.50 180.0 2. CE-CF-CH-HG 1 1.00 180.0 3. CE-CF-CH-CF 1 1.00 180.0 3. CF-CG-NF-CG 1 0.10 180.0 2. CF-CH-CF-HF 1 1.00 180.0 3. CF-CH-CF-CG 1 4.00 180.0 3. CH-CF-CG-HF 1 0.10 180.0 2. CH-CF-CG-NF 1 0.10 180.0 2. HG-CH-CF-CG 1 1.00 180.0 3. HG-CH-CF-HF 1 1.00 180.0 3. HF-CF-CG-HF 1 0.40 180.0 2. HF-CF-CG-NF 1 7.00 180.0 2. HF-CG-NF-CG 1 7.00 180.0 2. CF-CE-NE-HE 1 2.50 180.0 2. X -CT-NF-X 6 0.00 0.0 2. X -CG-NF-X 4 7.40 180.0 2. NONB NE 1.8240 0.170 NF 1.8240 0.170 OE 1.6612 0.210 CE 1.9080 0.086 CF 1.9080 0.086 CG 1.9080 0.086 CH 1.9080 0.086 HE 0.6000 0.0157 HF 0.6000 0.0157 HG 0.6000 0.0157