# distance restraint # 1 &rst iresid = 1, iat = 1, 1, atnam(1) = 'H8', atnam(2) = 'H5'1'', r1 = 2.030, r2 = 3.030, r3 = 6.430, r4 = 7.430, rk2 =10.000, rk3 =10.000, &end # distance restraint # 2 &rst iresid = 1, iat = 1, 1, atnam(1) = 'H8', atnam(2) = 'H4''', r1 = 3.660, r2 = 4.660, r3 = 6.760, r4 = 7.760, rk2 =10.000, rk3 =10.000, &end # distance restraint # 3 &rst iresid = 1, iat = 1, 1, atnam(1) = 'H8', atnam(2) = 'H1''', r1 = 2.840, r2 = 3.840, r3 = 6.170, r4 = 7.170, rk2 =10.000, rk3 =10.000, &end # distance restraint # 4 &rst iresid = 1, iat = 1, 1, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 1.100, r2 = 2.100, r3 = 2.760, r4 = 3.760, rk2 =10.000, rk3 =10.000, &end # distance restraint # 5 &rst iresid = 1, iat = 1, 1, atnam(1) = 'H3''', atnam(2) = 'H8', r1 = 2.020, r2 = 3.020, r3 = 5.410, r4 = 6.410, rk2 =10.000, rk3 =10.000, &end # distance restraint # 6 &rst iresid = 1, iat = 1, 1, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 1.670, r2 = 2.670, r3 = 5.400, r4 = 6.400, rk2 =10.000, rk3 =10.000, &end # distance restraint # 7 &rst iresid = 1, iat = 1, 1, atnam(1) = 'H2'1'', atnam(2) = 'H8', r1 = 2.230, r2 = 3.230, r3 = 5.650, r4 = 6.650, rk2 =10.000, rk3 =10.000, &end # distance restraint # 8 &rst iresid = 1, iat = 2, 1, atnam(1) = 'H1''', atnam(2) = 'H1''', r1 = 2.350, r2 = 3.350, r3 = 7.350, r4 = 8.350, rk2 =10.000, rk3 =10.000, &end # distance restraint # 9 &rst iresid = 1, iat = 2, 1, atnam(1) = 'H1''', atnam(2) = 'H2'1'', r1 = 2.290, r2 = 3.290, r3 = 6.490, r4 = 7.490, rk2 =10.000, rk3 =10.000, &end # distance restraint # 10 &rst iresid = 1, iat = 2, 1, atnam(1) = 'H8', atnam(2) = 'H1''', r1 = 2.920, r2 = 3.920, r3 = 5.850, r4 = 6.850, rk2 =10.000, rk3 =10.000, &end # distance restraint # 11 &rst iresid = 1, iat = 2, 1, atnam(1) = 'H8', atnam(2) = 'H8', r1 = 1.630, r2 = 2.630, r3 = 3.030, r4 = 4.030, rk2 =10.000, rk3 =10.000, &end # distance restraint # 12 &rst iresid = 1, iat = 2, 1, atnam(1) = 'H8', atnam(2) = 'H2'1'', r1 = 2.930, r2 = 3.930, r3 = 6.640, r4 = 7.640, rk2 =10.000, rk3 =10.000, &end # distance restraint # 13 &rst iresid = 1, iat = 2, 2, atnam(1) = 'H8', atnam(2) = 'H5'1'', r1 = 2.660, r2 = 3.660, r3 = 4.900, r4 = 5.900, rk2 =10.000, rk3 =10.000, &end # distance restraint # 14 &rst iresid = 1, iat = 2, 2, atnam(1) = 'H8', atnam(2) = 'H4''', r1 = 3.980, r2 = 4.980, r3 = 7.100, r4 = 8.100, rk2 =10.000, rk3 =10.000, &end # distance restraint # 15 &rst iresid = 1, iat = 2, 2, atnam(1) = 'H8', atnam(2) = 'H1''', r1 = 2.910, r2 = 3.910, r3 = 5.380, r4 = 6.380, rk2 =10.000, rk3 =10.000, &end # distance restraint # 16 &rst iresid = 1, iat = 2, 2, atnam(1) = 'H2', atnam(2) = 'H1''', r1 = 3.210, r2 = 4.210, r3 = 6.650, r4 = 7.650, rk2 =10.000, rk3 =10.000, &end # distance restraint # 17 &rst iresid = 1, iat = 2, 2, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 1.630, r2 = 2.630, r3 = 4.750, r4 = 5.750, rk2 =10.000, rk3 =10.000, &end # distance restraint # 18 &rst iresid = 1, iat = 2, 1, atnam(1) = 'H2'1'', atnam(2) = 'H8', r1 = 1.070, r2 = 2.070, r3 = 3.300, r4 = 4.300, rk2 =10.000, rk3 =10.000, &end # distance restraint # 19 &rst iresid = 1, iat = 2, 2, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 2.190, r2 = 3.190, r3 = 4.390, r4 = 5.390, rk2 =10.000, rk3 =10.000, &end # distance restraint # 20 &rst iresid = 1, iat = 2, 2, atnam(1) = 'H2'1'', atnam(2) = 'H8', r1 = 1.410, r2 = 2.410, r3 = 3.530, r4 = 4.530, rk2 =10.000, rk3 =10.000, &end # distance restraint # 21 &rst iresid = 1, iat = 3, 2, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 1.900, r2 = 2.900, r3 = 4.330, r4 = 5.330, rk2 =10.000, rk3 =10.000, &end # distance restraint # 22 &rst iresid = 1, iat = 3, 2, atnam(1) = 'H6', atnam(2) = 'H3''', r1 = 1.350, r2 = 2.350, r3 = 2.850, r4 = 3.850, rk2 =10.000, rk3 =10.000, &end # distance restraint # 23 &rst iresid = 1, iat = 3, 2, atnam(1) = 'H6', atnam(2) = 'H2'1'', r1 = 1.870, r2 = 2.870, r3 = 4.770, r4 = 5.770, rk2 =10.000, rk3 =10.000, &end # distance restraint # 24 &rst iresid = 1, iat = 3, 3, atnam(1) = 'H6', atnam(2) = 'H5'1'', r1 = 2.090, r2 = 3.090, r3 = 4.570, r4 = 5.570, rk2 =10.000, rk3 =10.000, &end # distance restraint # 25 &rst iresid = 1, iat = 3, 3, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 2.860, r2 = 3.860, r3 = 5.430, r4 = 6.430, rk2 =10.000, rk3 =10.000, &end # distance restraint # 26 &rst iresid = 1, iat = 3, 3, atnam(1) = 'H5', atnam(2) = 'H1''', r1 = 3.160, r2 = 4.160, r3 = 6.770, r4 = 7.770, rk2 =10.000, rk3 =10.000, &end # distance restraint # 27 &rst iresid = 1, iat = 3, 3, atnam(1) = 'H5', atnam(2) = 'H6', r1 = 2.350, r2 = 3.350, r3 = 5.780, r4 = 6.780, rk2 =10.000, rk3 =10.000, &end # distance restraint # 28 &rst iresid = 1, iat = 3, 2, atnam(1) = 'H3''', atnam(2) = 'H8', r1 = 2.170, r2 = 3.170, r3 = 3.900, r4 = 4.900, rk2 =10.000, rk3 =10.000, &end # distance restraint # 29 &rst iresid = 1, iat = 3, 3, atnam(1) = 'H3''', atnam(2) = 'H5', r1 = 2.490, r2 = 3.490, r3 = 6.060, r4 = 7.060, rk2 =10.000, rk3 =10.000, &end # distance restraint # 30 &rst iresid = 1, iat = 3, 3, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 2.010, r2 = 3.010, r3 = 3.390, r4 = 4.390, rk2 =10.000, rk3 =10.000, &end # distance restraint # 31 &rst iresid = 1, iat = 3, 3, atnam(1) = 'H2'1'', atnam(2) = 'H6', r1 = 2.390, r2 = 3.390, r3 = 5.920, r4 = 6.920, rk2 =10.000, rk3 =10.000, &end # distance restraint # 32 &rst iresid = 1, iat = 4, 3, atnam(1) = 'H1''', atnam(2) = 'H2'1'', r1 = 2.890, r2 = 3.890, r3 = 6.060, r4 = 7.060, rk2 =10.000, rk3 =10.000, &end # distance restraint # 33 &rst iresid = 1, iat = 4, 3, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 2.420, r2 = 3.420, r3 = 5.300, r4 = 6.300, rk2 =10.000, rk3 =10.000, &end # distance restraint # 34 &rst iresid = 1, iat = 4, 3, atnam(1) = 'H6', atnam(2) = 'H3''', r1 = 1.220, r2 = 2.220, r3 = 2.790, r4 = 3.790, rk2 =10.000, rk3 =10.000, &end # distance restraint # 35 &rst iresid = 1, iat = 4, 3, atnam(1) = 'H6', atnam(2) = 'H2'1'', r1 = 1.760, r2 = 2.760, r3 = 4.850, r4 = 5.850, rk2 =10.000, rk3 =10.000, &end # distance restraint # 36 &rst iresid = 1, iat = 4, 4, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 2.680, r2 = 3.680, r3 = 5.830, r4 = 6.830, rk2 =10.000, rk3 =10.000, &end # distance restraint # 37 &rst iresid = 1, iat = 4, 3, atnam(1) = 'H5', atnam(2) = 'H2'1'', r1 = 2.960, r2 = 3.960, r3 = 5.810, r4 = 6.810, rk2 =10.000, rk3 =10.000, &end # distance restraint # 38 &rst iresid = 1, iat = 4, 4, atnam(1) = 'H5', atnam(2) = 'H6', r1 = 2.400, r2 = 3.400, r3 = 5.260, r4 = 6.260, rk2 =10.000, rk3 =10.000, &end # distance restraint # 39 &rst iresid = 1, iat = 4, 4, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 3.130, r2 = 4.130, r3 = 5.940, r4 = 6.940, rk2 =10.000, rk3 =10.000, &end # distance restraint # 40 &rst iresid = 1, iat = 4, 3, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 2.540, r2 = 3.540, r3 = 6.410, r4 = 7.410, rk2 =10.000, rk3 =10.000, &end # distance restraint # 41 &rst iresid = 1, iat = 4, 3, atnam(1) = 'H2'1'', atnam(2) = 'H6', r1 = 1.510, r2 = 2.510, r3 = 2.920, r4 = 3.920, rk2 =10.000, rk3 =10.000, &end # distance restraint # 42 &rst iresid = 1, iat = 4, 4, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 1.820, r2 = 2.820, r3 = 5.180, r4 = 6.180, rk2 =10.000, rk3 =10.000, &end # distance restraint # 43 &rst iresid = 1, iat = 4, 4, atnam(1) = 'H2'1'', atnam(2) = 'H6', r1 = 2.160, r2 = 3.160, r3 = 4.340, r4 = 5.340, rk2 =10.000, rk3 =10.000, &end # distance restraint # 44 &rst iresid = 1, iat = 4, 4, atnam(1) = 'H2'1'', atnam(2) = 'H5', r1 = 2.480, r2 = 3.480, r3 = 5.600, r4 = 6.600, rk2 =10.000, rk3 =10.000, &end # distance restraint # 45 &rst iresid = 1, iat = 5, 4, atnam(1) = 'H1''', atnam(2) = 'H5', r1 = 3.150, r2 = 4.150, r3 = 7.280, r4 = 8.280, rk2 =10.000, rk3 =10.000, &end # distance restraint # 46 &rst iresid = 1, iat = 5, 4, atnam(1) = 'H1''', atnam(2) = 'H3''', r1 = 2.800, r2 = 3.800, r3 = 6.240, r4 = 7.240, rk2 =10.000, rk3 =10.000, &end # distance restraint # 47 &rst iresid = 1, iat = 5, 4, atnam(1) = 'H8', atnam(2) = 'H6', r1 = 2.140, r2 = 3.140, r3 = 5.220, r4 = 6.220, rk2 =10.000, rk3 =10.000, &end # distance restraint # 48 &rst iresid = 1, iat = 5, 4, atnam(1) = 'H8', atnam(2) = 'H3''', r1 = 2.200, r2 = 3.200, r3 = 4.800, r4 = 5.800, rk2 =10.000, rk3 =10.000, &end # distance restraint # 49 &rst iresid = 1, iat = 5, 4, atnam(1) = 'H8', atnam(2) = 'H2'1'', r1 = 1.830, r2 = 2.830, r3 = 3.760, r4 = 4.760, rk2 =10.000, rk3 =10.000, &end # distance restraint # 50 &rst iresid = 1, iat = 5, 5, atnam(1) = 'H8', atnam(2) = 'H1''', r1 = 2.480, r2 = 3.480, r3 = 5.780, r4 = 6.780, rk2 =10.000, rk3 =10.000, &end # distance restraint # 51 &rst iresid = 1, iat = 5, 5, atnam(1) = 'H2', atnam(2) = 'H1''', r1 = 3.150, r2 = 4.150, r3 = 6.390, r4 = 7.390, rk2 =10.000, rk3 =10.000, &end # distance restraint # 52 &rst iresid = 1, iat = 5, 5, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 2.360, r2 = 3.360, r3 = 5.770, r4 = 6.770, rk2 =10.000, rk3 =10.000, &end # distance restraint # 53 &rst iresid = 1, iat = 5, 5, atnam(1) = 'H3''', atnam(2) = 'H8', r1 = 1.280, r2 = 2.280, r3 = 3.340, r4 = 4.340, rk2 =10.000, rk3 =10.000, &end # distance restraint # 54 &rst iresid = 1, iat = 5, 4, atnam(1) = 'H2'1'', atnam(2) = 'H5', r1 = 2.900, r2 = 3.900, r3 = 6.500, r4 = 7.500, rk2 =10.000, rk3 =10.000, &end # distance restraint # 55 &rst iresid = 1, iat = 5, 5, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 1.960, r2 = 2.960, r3 = 4.350, r4 = 5.350, rk2 =10.000, rk3 =10.000, &end # distance restraint # 56 &rst iresid = 1, iat = 5, 5, atnam(1) = 'H2'1'', atnam(2) = 'H8', r1 = 1.880, r2 = 2.880, r3 = 5.850, r4 = 6.850, rk2 =10.000, rk3 =10.000, &end # distance restraint # 57 &rst iresid = 1, iat = 6, 5, atnam(1) = 'H1''', atnam(2) = 'H2', r1 = 3.900, r2 = 4.900, r3 = 6.490, r4 = 7.490, rk2 =10.000, rk3 =10.000, &end # distance restraint # 58 &rst iresid = 1, iat = 6, 6, atnam(1) = 'H1''', atnam(2) = 'H5'1'', r1 = 3.450, r2 = 4.450, r3 = 5.980, r4 = 6.980, rk2 =10.000, rk3 =10.000, &end # distance restraint # 59 &rst iresid = 1, iat = 6, 5, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 2.040, r2 = 3.040, r3 = 4.470, r4 = 5.470, rk2 =10.000, rk3 =10.000, &end # distance restraint # 60 &rst iresid = 1, iat = 6, 5, atnam(1) = 'H6', atnam(2) = 'H2', r1 = 2.790, r2 = 3.790, r3 = 5.860, r4 = 6.860, rk2 =10.000, rk3 =10.000, &end # distance restraint # 61 &rst iresid = 1, iat = 6, 5, atnam(1) = 'H6', atnam(2) = 'H3''', r1 = 1.510, r2 = 2.510, r3 = 3.800, r4 = 4.800, rk2 =10.000, rk3 =10.000, &end # distance restraint # 62 &rst iresid = 1, iat = 6, 5, atnam(1) = 'H6', atnam(2) = 'H2'1'', r1 = 1.720, r2 = 2.720, r3 = 4.070, r4 = 5.070, rk2 =10.000, rk3 =10.000, &end # distance restraint # 63 &rst iresid = 1, iat = 6, 6, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 2.190, r2 = 3.190, r3 = 3.940, r4 = 4.940, rk2 =10.000, rk3 =10.000, &end # distance restraint # 64 &rst iresid = 1, iat = 6, 6, atnam(1) = 'H5', atnam(2) = 'H5'1'', r1 = 3.080, r2 = 4.080, r3 = 5.010, r4 = 6.010, rk2 =10.000, rk3 =10.000, &end # distance restraint # 65 &rst iresid = 1, iat = 6, 6, atnam(1) = 'H5', atnam(2) = 'H4''', r1 = 3.780, r2 = 4.780, r3 = 6.510, r4 = 7.510, rk2 =10.000, rk3 =10.000, &end # distance restraint # 66 &rst iresid = 1, iat = 6, 6, atnam(1) = 'H5', atnam(2) = 'H6', r1 = 2.490, r2 = 3.490, r3 = 5.660, r4 = 6.660, rk2 =10.000, rk3 =10.000, &end # distance restraint # 67 &rst iresid = 1, iat = 6, 6, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 1.550, r2 = 2.550, r3 = 2.670, r4 = 3.670, rk2 =10.000, rk3 =10.000, &end # distance restraint # 68 &rst iresid = 1, iat = 6, 6, atnam(1) = 'H3''', atnam(2) = 'H6', r1 = 3.100, r2 = 4.100, r3 = 6.360, r4 = 7.360, rk2 =10.000, rk3 =10.000, &end # distance restraint # 69 &rst iresid = 1, iat = 6, 5, atnam(1) = 'H2'1'', atnam(2) = 'H8', r1 = 2.600, r2 = 3.600, r3 = 5.820, r4 = 6.820, rk2 =10.000, rk3 =10.000, &end # distance restraint # 70 &rst iresid = 1, iat = 6, 6, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 1.860, r2 = 2.860, r3 = 3.230, r4 = 4.230, rk2 =10.000, rk3 =10.000, &end # distance restraint # 71 &rst iresid = 1, iat = 6, 6, atnam(1) = 'H2'1'', atnam(2) = 'H6', r1 = 2.760, r2 = 3.760, r3 = 5.520, r4 = 6.520, rk2 =10.000, rk3 =10.000, &end # distance restraint # 72 &rst iresid = 1, iat = 7, 6, atnam(1) = 'H1''', atnam(2) = 'H2'1'', r1 = 1.500, r2 = 2.500, r3 = 2.740, r4 = 3.740, rk2 =10.000, rk3 =10.000, &end # distance restraint # 73 &rst iresid = 1, iat = 7, 7, atnam(1) = 'H1''', atnam(2) = 'H4''', r1 = 1.480, r2 = 2.480, r3 = 3.490, r4 = 4.490, rk2 =10.000, rk3 =10.000, &end # distance restraint # 74 &rst iresid = 1, iat = 7, 6, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 1.610, r2 = 2.610, r3 = 2.690, r4 = 3.690, rk2 =10.000, rk3 =10.000, &end # distance restraint # 75 &rst iresid = 1, iat = 7, 6, atnam(1) = 'H6', atnam(2) = 'H3''', r1 = 2.520, r2 = 3.520, r3 = 4.340, r4 = 5.340, rk2 =10.000, rk3 =10.000, &end # distance restraint # 76 &rst iresid = 1, iat = 7, 6, atnam(1) = 'H6', atnam(2) = 'H2'1'', r1 = 2.220, r2 = 3.220, r3 = 4.820, r4 = 5.820, rk2 =10.000, rk3 =10.000, &end # distance restraint # 77 &rst iresid = 1, iat = 7, 7, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 1.890, r2 = 2.890, r3 = 3.570, r4 = 4.570, rk2 =10.000, rk3 =10.000, &end # distance restraint # 78 &rst iresid = 1, iat = 7, 6, atnam(1) = 'H5', atnam(2) = 'H5', r1 = 3.390, r2 = 4.390, r3 = 6.920, r4 = 7.920, rk2 =10.000, rk3 =10.000, &end # distance restraint # 79 &rst iresid = 1, iat = 7, 7, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 2.060, r2 = 3.060, r3 = 4.040, r4 = 5.040, rk2 =10.000, rk3 =10.000, &end # distance restraint # 80 &rst iresid = 1, iat = 7, 7, atnam(1) = 'H3''', atnam(2) = 'H6', r1 = 1.790, r2 = 2.790, r3 = 3.770, r4 = 4.770, rk2 =10.000, rk3 =10.000, &end # distance restraint # 81 &rst iresid = 1, iat = 7, 7, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 1.740, r2 = 2.740, r3 = 5.030, r4 = 6.030, rk2 =10.000, rk3 =10.000, &end # distance restraint # 82 &rst iresid = 1, iat = 7, 7, atnam(1) = 'H2'1'', atnam(2) = 'H6', r1 = 1.870, r2 = 2.870, r3 = 3.220, r4 = 4.220, rk2 =10.000, rk3 =10.000, &end # distance restraint # 83 &rst iresid = 1, iat = 8, 7, atnam(1) = 'H1''', atnam(2) = 'H3''', r1 = 2.380, r2 = 3.380, r3 = 5.070, r4 = 6.070, rk2 =10.000, rk3 =10.000, &end # distance restraint # 84 &rst iresid = 1, iat = 8, 7, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 2.060, r2 = 3.060, r3 = 3.610, r4 = 4.610, rk2 =10.000, rk3 =10.000, &end # distance restraint # 85 &rst iresid = 1, iat = 8, 7, atnam(1) = 'H6', atnam(2) = 'H3''', r1 = 2.140, r2 = 3.140, r3 = 5.340, r4 = 6.340, rk2 =10.000, rk3 =10.000, &end # distance restraint # 86 &rst iresid = 1, iat = 8, 7, atnam(1) = 'H6', atnam(2) = 'H2'1'', r1 = 2.080, r2 = 3.080, r3 = 4.210, r4 = 5.210, rk2 =10.000, rk3 =10.000, &end # distance restraint # 87 &rst iresid = 1, iat = 8, 8, atnam(1) = 'H5', atnam(2) = 'H6', r1 = 3.240, r2 = 4.240, r3 = 6.310, r4 = 7.310, rk2 =10.000, rk3 =10.000, &end # distance restraint # 88 &rst iresid = 1, iat = 8, 7, atnam(1) = 'H3''', atnam(2) = 'H6', r1 = 2.220, r2 = 3.220, r3 = 3.370, r4 = 4.370, rk2 =10.000, rk3 =10.000, &end # distance restraint # 89 &rst iresid = 1, iat = 8, 8, atnam(1) = 'H3''', atnam(2) = 'H6', r1 = 2.830, r2 = 3.830, r3 = 6.380, r4 = 7.380, rk2 =10.000, rk3 =10.000, &end # distance restraint # 90 &rst iresid = 1, iat = 8, 8, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 2.060, r2 = 3.060, r3 = 6.260, r4 = 7.260, rk2 =10.000, rk3 =10.000, &end # distance restraint # 91 &rst iresid = 1, iat = 8, 8, atnam(1) = 'H2'1'', atnam(2) = 'H6', r1 = 1.450, r2 = 2.450, r3 = 2.880, r4 = 3.880, rk2 =10.000, rk3 =10.000, &end # distance restraint # 92 &rst iresid = 1, iat = 9, 8, atnam(1) = 'H8', atnam(2) = 'H6', r1 = 3.090, r2 = 4.090, r3 = 6.510, r4 = 7.510, rk2 =10.000, rk3 =10.000, &end # distance restraint # 93 &rst iresid = 1, iat = 9, 8, atnam(1) = 'H8', atnam(2) = 'H3''', r1 = 1.810, r2 = 2.810, r3 = 3.770, r4 = 4.770, rk2 =10.000, rk3 =10.000, &end # distance restraint # 94 &rst iresid = 1, iat = 9, 8, atnam(1) = 'H8', atnam(2) = 'H2'1'', r1 = 3.220, r2 = 4.220, r3 = 6.200, r4 = 7.200, rk2 =10.000, rk3 =10.000, &end # distance restraint # 95 &rst iresid = 1, iat = 9, 9, atnam(1) = 'H8', atnam(2) = 'H4''', r1 = 2.370, r2 = 3.370, r3 = 7.080, r4 = 8.080, rk2 =10.000, rk3 =10.000, &end # distance restraint # 96 &rst iresid = 1, iat = 9, 9, atnam(1) = 'H8', atnam(2) = 'H1''', r1 = 2.310, r2 = 3.310, r3 = 5.150, r4 = 6.150, rk2 =10.000, rk3 =10.000, &end # distance restraint # 97 &rst iresid = 1, iat = 9, 9, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 1.930, r2 = 2.930, r3 = 4.710, r4 = 5.710, rk2 =10.000, rk3 =10.000, &end # distance restraint # 98 &rst iresid = 1, iat = 9, 8, atnam(1) = 'H2'1'', atnam(2) = 'H6', r1 = 1.950, r2 = 2.950, r3 = 3.550, r4 = 4.550, rk2 =10.000, rk3 =10.000, &end # distance restraint # 99 &rst iresid = 1, iat = 10, 10, atnam(1) = 'H1''', atnam(2) = 'H5'1'', r1 = 1.180, r2 = 2.180, r3 = 2.930, r4 = 3.930, rk2 =10.000, rk3 =10.000, &end # distance restraint # 100 &rst iresid = 1, iat = 10, 9, atnam(1) = 'H6', atnam(2) = 'H2'1'', r1 = 2.130, r2 = 3.130, r3 = 5.030, r4 = 6.030, rk2 =10.000, rk3 =10.000, &end # distance restraint # 101 &rst iresid = 1, iat = 10, 10, atnam(1) = 'H6', atnam(2) = 'H5'1'', r1 = 2.420, r2 = 3.420, r3 = 4.510, r4 = 5.510, rk2 =10.000, rk3 =10.000, &end # distance restraint # 102 &rst iresid = 1, iat = 10, 10, atnam(1) = 'H6', atnam(2) = 'H4''', r1 = 3.570, r2 = 4.570, r3 = 6.110, r4 = 7.110, rk2 =10.000, rk3 =10.000, &end # distance restraint # 103 &rst iresid = 1, iat = 10, 10, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 2.040, r2 = 3.040, r3 = 4.650, r4 = 5.650, rk2 =10.000, rk3 =10.000, &end # distance restraint # 104 &rst iresid = 1, iat = 10, 10, atnam(1) = 'H5', atnam(2) = 'H1''', r1 = 3.030, r2 = 4.030, r3 = 5.550, r4 = 6.550, rk2 =10.000, rk3 =10.000, &end # distance restraint # 105 &rst iresid = 1, iat = 10, 10, atnam(1) = 'H5', atnam(2) = 'H6', r1 = 2.730, r2 = 3.730, r3 = 4.840, r4 = 5.840, rk2 =10.000, rk3 =10.000, &end # distance restraint # 106 &rst iresid = 1, iat = 10, 10, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 1.620, r2 = 2.620, r3 = 4.960, r4 = 5.960, rk2 =10.000, rk3 =10.000, &end # distance restraint # 107 &rst iresid = 1, iat = 10, 10, atnam(1) = 'H3''', atnam(2) = 'H6', r1 = 1.270, r2 = 2.270, r3 = 2.860, r4 = 3.860, rk2 =10.000, rk3 =10.000, &end # distance restraint # 108 &rst iresid = 1, iat = 10, 10, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 2.160, r2 = 3.160, r3 = 4.090, r4 = 5.090, rk2 =10.000, rk3 =10.000, &end # distance restraint # 109 &rst iresid = 1, iat = 10, 10, atnam(1) = 'H2'1'', atnam(2) = 'H6', r1 = 1.820, r2 = 2.820, r3 = 4.580, r4 = 5.580, rk2 =10.000, rk3 =10.000, &end # distance restraint # 110 &rst iresid = 1, iat = 11, 10, atnam(1) = 'H1''', atnam(2) = 'H3''', r1 = 2.110, r2 = 3.110, r3 = 4.930, r4 = 5.930, rk2 =10.000, rk3 =10.000, &end # distance restraint # 111 &rst iresid = 1, iat = 11, 10, atnam(1) = 'H1''', atnam(2) = 'H2'1'', r1 = 2.080, r2 = 3.080, r3 = 5.000, r4 = 6.000, rk2 =10.000, rk3 =10.000, &end # distance restraint # 112 &rst iresid = 1, iat = 11, 10, atnam(1) = 'H8', atnam(2) = 'H1''', r1 = 1.820, r2 = 2.820, r3 = 4.980, r4 = 5.980, rk2 =10.000, rk3 =10.000, &end # distance restraint # 113 &rst iresid = 1, iat = 11, 10, atnam(1) = 'H8', atnam(2) = 'H6', r1 = 1.570, r2 = 2.570, r3 = 3.860, r4 = 4.860, rk2 =10.000, rk3 =10.000, &end # distance restraint # 114 &rst iresid = 1, iat = 11, 10, atnam(1) = 'H8', atnam(2) = 'H3''', r1 = 1.390, r2 = 2.390, r3 = 4.760, r4 = 5.760, rk2 =10.000, rk3 =10.000, &end # distance restraint # 115 &rst iresid = 1, iat = 11, 10, atnam(1) = 'H8', atnam(2) = 'H2'1'', r1 = 1.560, r2 = 2.560, r3 = 4.760, r4 = 5.760, rk2 =10.000, rk3 =10.000, &end # distance restraint # 116 &rst iresid = 1, iat = 11, 11, atnam(1) = 'H8', atnam(2) = 'H1''', r1 = 2.290, r2 = 3.290, r3 = 6.420, r4 = 7.420, rk2 =10.000, rk3 =10.000, &end # distance restraint # 117 &rst iresid = 1, iat = 11, 9, atnam(1) = 'H2', atnam(2) = 'H1''', r1 = 3.310, r2 = 4.310, r3 = 6.030, r4 = 7.030, rk2 =10.000, rk3 =10.000, &end # distance restraint # 118 &rst iresid = 1, iat = 11, 11, atnam(1) = 'H2', atnam(2) = 'H1''', r1 = 3.440, r2 = 4.440, r3 = 5.770, r4 = 6.770, rk2 =10.000, rk3 =10.000, &end # distance restraint # 119 &rst iresid = 1, iat = 11, 11, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 2.100, r2 = 3.100, r3 = 5.130, r4 = 6.130, rk2 =10.000, rk3 =10.000, &end # distance restraint # 120 &rst iresid = 1, iat = 11, 11, atnam(1) = 'H3''', atnam(2) = 'H8', r1 = 2.320, r2 = 3.320, r3 = 5.540, r4 = 6.540, rk2 =10.000, rk3 =10.000, &end # distance restraint # 121 &rst iresid = 1, iat = 11, 11, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 1.160, r2 = 2.160, r3 = 2.810, r4 = 3.810, rk2 =10.000, rk3 =10.000, &end # distance restraint # 122 &rst iresid = 1, iat = 11, 11, atnam(1) = 'H2'1'', atnam(2) = 'H8', r1 = 1.750, r2 = 2.750, r3 = 5.110, r4 = 6.110, rk2 =10.000, rk3 =10.000, &end # distance restraint # 123 &rst iresid = 1, iat = 12, 11, atnam(1) = 'H1''', atnam(2) = 'H2', r1 = 3.230, r2 = 4.230, r3 = 6.000, r4 = 7.000, rk2 =10.000, rk3 =10.000, &end # distance restraint # 124 &rst iresid = 1, iat = 12, 11, atnam(1) = 'H8', atnam(2) = 'H1''', r1 = 2.890, r2 = 3.890, r3 = 6.430, r4 = 7.430, rk2 =10.000, rk3 =10.000, &end # distance restraint # 125 &rst iresid = 1, iat = 12, 11, atnam(1) = 'H8', atnam(2) = 'H8', r1 = 2.450, r2 = 3.450, r3 = 5.950, r4 = 6.950, rk2 =10.000, rk3 =10.000, &end # distance restraint # 126 &rst iresid = 1, iat = 12, 11, atnam(1) = 'H8', atnam(2) = 'H3''', r1 = 2.360, r2 = 3.360, r3 = 5.070, r4 = 6.070, rk2 =10.000, rk3 =10.000, &end # distance restraint # 127 &rst iresid = 1, iat = 12, 11, atnam(1) = 'H8', atnam(2) = 'H2'1'', r1 = 2.080, r2 = 3.080, r3 = 5.650, r4 = 6.650, rk2 =10.000, rk3 =10.000, &end # distance restraint # 128 &rst iresid = 1, iat = 12, 12, atnam(1) = 'H8', atnam(2) = 'H1''', r1 = 2.080, r2 = 3.080, r3 = 5.650, r4 = 6.650, rk2 =10.000, rk3 =10.000, &end # distance restraint # 129 &rst iresid = 1, iat = 12, 12, atnam(1) = 'H3''', atnam(2) = 'H8', r1 = 1.210, r2 = 2.210, r3 = 2.580, r4 = 3.580, rk2 =10.000, rk3 =10.000, &end # distance restraint # 130 &rst iresid = 1, iat = 12, 12, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 2.640, r2 = 3.640, r3 = 4.660, r4 = 5.660, rk2 =10.000, rk3 =10.000, &end # distance restraint # 131 &rst iresid = 1, iat = 12, 12, atnam(1) = 'H2'1'', atnam(2) = 'H8', r1 = 1.840, r2 = 2.840, r3 = 4.200, r4 = 5.200, rk2 =10.000, rk3 =10.000, &end # distance restraint # 132 &rst iresid = 1, iat = 13, 13, atnam(1) = 'H1''', atnam(2) = 'H5'1'', r1 = 1.460, r2 = 2.460, r3 = 3.290, r4 = 4.290, rk2 =10.000, rk3 =10.000, &end # distance restraint # 133 &rst iresid = 1, iat = 13, 13, atnam(1) = 'H1''', atnam(2) = 'H4''', r1 = 3.350, r2 = 4.350, r3 = 6.320, r4 = 7.320, rk2 =10.000, rk3 =10.000, &end # distance restraint # 134 &rst iresid = 1, iat = 13, 12, atnam(1) = 'H8', atnam(2) = 'H1''', r1 = 2.420, r2 = 3.420, r3 = 5.840, r4 = 6.840, rk2 =10.000, rk3 =10.000, &end # distance restraint # 135 &rst iresid = 1, iat = 13, 12, atnam(1) = 'H8', atnam(2) = 'H3''', r1 = 1.670, r2 = 2.670, r3 = 3.460, r4 = 4.460, rk2 =10.000, rk3 =10.000, &end # distance restraint # 136 &rst iresid = 1, iat = 13, 12, atnam(1) = 'H8', atnam(2) = 'H2'1'', r1 = 1.940, r2 = 2.940, r3 = 5.110, r4 = 6.110, rk2 =10.000, rk3 =10.000, &end # distance restraint # 137 &rst iresid = 1, iat = 13, 13, atnam(1) = 'H8', atnam(2) = 'H1''', r1 = 2.540, r2 = 3.540, r3 = 5.610, r4 = 6.610, rk2 =10.000, rk3 =10.000, &end # distance restraint # 138 &rst iresid = 1, iat = 13, 12, atnam(1) = 'H3''', atnam(2) = 'H8', r1 = 1.480, r2 = 2.480, r3 = 4.290, r4 = 5.290, rk2 =10.000, rk3 =10.000, &end # distance restraint # 139 &rst iresid = 1, iat = 13, 13, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 1.880, r2 = 2.880, r3 = 5.030, r4 = 6.030, rk2 =10.000, rk3 =10.000, &end # distance restraint # 140 &rst iresid = 1, iat = 13, 13, atnam(1) = 'H3''', atnam(2) = 'H8', r1 = 2.160, r2 = 3.160, r3 = 5.550, r4 = 6.550, rk2 =10.000, rk3 =10.000, &end # distance restraint # 141 &rst iresid = 1, iat = 13, 12, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 1.720, r2 = 2.720, r3 = 4.100, r4 = 5.100, rk2 =10.000, rk3 =10.000, &end # distance restraint # 142 &rst iresid = 1, iat = 13, 13, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 2.420, r2 = 3.420, r3 = 5.430, r4 = 6.430, rk2 =10.000, rk3 =10.000, &end # distance restraint # 143 &rst iresid = 1, iat = 13, 13, atnam(1) = 'H2'1'', atnam(2) = 'H8', r1 = 1.440, r2 = 2.440, r3 = 2.890, r4 = 3.890, rk2 =10.000, rk3 =10.000, &end # distance restraint # 144 &rst iresid = 1, iat = 14, 14, atnam(1) = 'H1''', atnam(2) = 'H4''', r1 = 2.590, r2 = 3.590, r3 = 4.730, r4 = 5.730, rk2 =10.000, rk3 =10.000, &end # distance restraint # 145 &rst iresid = 1, iat = 14, 13, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 2.940, r2 = 3.940, r3 = 5.890, r4 = 6.890, rk2 =10.000, rk3 =10.000, &end # distance restraint # 146 &rst iresid = 1, iat = 14, 13, atnam(1) = 'H6', atnam(2) = 'H3''', r1 = 1.700, r2 = 2.700, r3 = 2.990, r4 = 3.990, rk2 =10.000, rk3 =10.000, &end # distance restraint # 147 &rst iresid = 1, iat = 14, 13, atnam(1) = 'H6', atnam(2) = 'H2'1'', r1 = 1.730, r2 = 2.730, r3 = 3.010, r4 = 4.010, rk2 =10.000, rk3 =10.000, &end # distance restraint # 148 &rst iresid = 1, iat = 14, 14, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 3.830, r2 = 4.830, r3 = 6.960, r4 = 7.960, rk2 =10.000, rk3 =10.000, &end # distance restraint # 149 &rst iresid = 1, iat = 14, 13, atnam(1) = 'H5', atnam(2) = 'H1''', r1 = 3.320, r2 = 4.320, r3 = 7.410, r4 = 8.410, rk2 =10.000, rk3 =10.000, &end # distance restraint # 150 &rst iresid = 1, iat = 14, 13, atnam(1) = 'H5', atnam(2) = 'H8', r1 = 2.980, r2 = 3.980, r3 = 6.730, r4 = 7.730, rk2 =10.000, rk3 =10.000, &end # distance restraint # 151 &rst iresid = 1, iat = 14, 13, atnam(1) = 'H5', atnam(2) = 'H3''', r1 = 2.110, r2 = 3.110, r3 = 5.060, r4 = 6.060, rk2 =10.000, rk3 =10.000, &end # distance restraint # 152 &rst iresid = 1, iat = 14, 13, atnam(1) = 'H5', atnam(2) = 'H2'1'', r1 = 2.510, r2 = 3.510, r3 = 4.790, r4 = 5.790, rk2 =10.000, rk3 =10.000, &end # distance restraint # 153 &rst iresid = 1, iat = 14, 14, atnam(1) = 'H5', atnam(2) = 'H4''', r1 = 3.000, r2 = 4.000, r3 = 6.460, r4 = 7.460, rk2 =10.000, rk3 =10.000, &end # distance restraint # 154 &rst iresid = 1, iat = 14, 14, atnam(1) = 'H5', atnam(2) = 'H6', r1 = 3.290, r2 = 4.290, r3 = 6.380, r4 = 7.380, rk2 =10.000, rk3 =10.000, &end # distance restraint # 155 &rst iresid = 1, iat = 14, 14, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 3.570, r2 = 4.570, r3 = 5.920, r4 = 6.920, rk2 =10.000, rk3 =10.000, &end # distance restraint # 156 &rst iresid = 1, iat = 14, 14, atnam(1) = 'H2'1'', atnam(2) = 'H6', r1 = 4.100, r2 = 5.100, r3 = 6.730, r4 = 7.730, rk2 =10.000, rk3 =10.000, &end # distance restraint # 157 &rst iresid = 1, iat = 15, 5, atnam(1) = 'H1''', atnam(2) = 'H2', r1 = 3.090, r2 = 4.090, r3 = 6.520, r4 = 7.520, rk2 =10.000, rk3 =10.000, &end # distance restraint # 158 &rst iresid = 1, iat = 15, 14, atnam(1) = 'H1''', atnam(2) = 'H1''', r1 = 3.890, r2 = 4.890, r3 = 6.690, r4 = 7.690, rk2 =10.000, rk3 =10.000, &end # distance restraint # 159 &rst iresid = 1, iat = 15, 5, atnam(1) = 'H8', atnam(2) = 'H2', r1 = 3.080, r2 = 4.080, r3 = 5.920, r4 = 6.920, rk2 =10.000, rk3 =10.000, &end # distance restraint # 160 &rst iresid = 1, iat = 15, 14, atnam(1) = 'H8', atnam(2) = 'H1''', r1 = 2.370, r2 = 3.370, r3 = 4.860, r4 = 5.860, rk2 =10.000, rk3 =10.000, &end # distance restraint # 161 &rst iresid = 1, iat = 15, 14, atnam(1) = 'H8', atnam(2) = 'H6', r1 = 3.700, r2 = 4.700, r3 = 7.060, r4 = 8.060, rk2 =10.000, rk3 =10.000, &end # distance restraint # 162 &rst iresid = 1, iat = 15, 14, atnam(1) = 'H8', atnam(2) = 'H2'1'', r1 = 2.070, r2 = 3.070, r3 = 4.920, r4 = 5.920, rk2 =10.000, rk3 =10.000, &end # distance restraint # 163 &rst iresid = 1, iat = 15, 15, atnam(1) = 'H8', atnam(2) = 'H5'1'', r1 = 2.670, r2 = 3.670, r3 = 4.980, r4 = 5.980, rk2 =10.000, rk3 =10.000, &end # distance restraint # 164 &rst iresid = 1, iat = 15, 15, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 2.910, r2 = 3.910, r3 = 5.640, r4 = 6.640, rk2 =10.000, rk3 =10.000, &end # distance restraint # 165 &rst iresid = 1, iat = 15, 15, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 2.220, r2 = 3.220, r3 = 5.860, r4 = 6.860, rk2 =10.000, rk3 =10.000, &end # distance restraint # 166 &rst iresid = 1, iat = 15, 15, atnam(1) = 'H2'1'', atnam(2) = 'H8', r1 = 1.350, r2 = 2.350, r3 = 2.520, r4 = 3.520, rk2 =10.000, rk3 =10.000, &end # distance restraint # 167 &rst iresid = 1, iat = 16, 15, atnam(1) = 'H6', atnam(2) = 'H2'1'', r1 = 1.750, r2 = 2.750, r3 = 3.170, r4 = 4.170, rk2 =10.000, rk3 =10.000, &end # distance restraint # 168 &rst iresid = 1, iat = 16, 16, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 2.520, r2 = 3.520, r3 = 5.350, r4 = 6.350, rk2 =10.000, rk3 =10.000, &end # distance restraint # 169 &rst iresid = 1, iat = 16, 15, atnam(1) = 'H5', atnam(2) = 'H1''', r1 = 2.150, r2 = 3.150, r3 = 4.220, r4 = 5.220, rk2 =10.000, rk3 =10.000, &end # distance restraint # 170 &rst iresid = 1, iat = 16, 15, atnam(1) = 'H5', atnam(2) = 'H2'1'', r1 = 1.770, r2 = 2.770, r3 = 4.220, r4 = 5.220, rk2 =10.000, rk3 =10.000, &end # distance restraint # 171 &rst iresid = 1, iat = 16, 16, atnam(1) = 'H5', atnam(2) = 'H4''', r1 = 3.440, r2 = 4.440, r3 = 6.440, r4 = 7.440, rk2 =10.000, rk3 =10.000, &end # distance restraint # 172 &rst iresid = 1, iat = 16, 16, atnam(1) = 'H5', atnam(2) = 'H1''', r1 = 3.200, r2 = 4.200, r3 = 6.520, r4 = 7.520, rk2 =10.000, rk3 =10.000, &end # distance restraint # 173 &rst iresid = 1, iat = 16, 16, atnam(1) = 'H5', atnam(2) = 'H6', r1 = 2.610, r2 = 3.610, r3 = 5.990, r4 = 6.990, rk2 =10.000, rk3 =10.000, &end # distance restraint # 174 &rst iresid = 1, iat = 16, 16, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 1.180, r2 = 2.180, r3 = 2.460, r4 = 3.460, rk2 =10.000, rk3 =10.000, &end # distance restraint # 175 &rst iresid = 1, iat = 16, 16, atnam(1) = 'H3''', atnam(2) = 'H6', r1 = 2.310, r2 = 3.310, r3 = 5.320, r4 = 6.320, rk2 =10.000, rk3 =10.000, &end # distance restraint # 176 &rst iresid = 1, iat = 16, 16, atnam(1) = 'H3''', atnam(2) = 'H5', r1 = 3.130, r2 = 4.130, r3 = 7.050, r4 = 8.050, rk2 =10.000, rk3 =10.000, &end # distance restraint # 177 &rst iresid = 1, iat = 16, 16, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 1.990, r2 = 2.990, r3 = 4.380, r4 = 5.380, rk2 =10.000, rk3 =10.000, &end # distance restraint # 178 &rst iresid = 1, iat = 16, 16, atnam(1) = 'H2'1'', atnam(2) = 'H6', r1 = 2.450, r2 = 3.450, r3 = 6.230, r4 = 7.230, rk2 =10.000, rk3 =10.000, &end # distance restraint # 179 &rst iresid = 1, iat = 17, 16, atnam(1) = 'H1''', atnam(2) = 'H1''', r1 = 2.930, r2 = 3.930, r3 = 5.560, r4 = 6.560, rk2 =10.000, rk3 =10.000, &end # distance restraint # 180 &rst iresid = 1, iat = 17, 17, atnam(1) = 'H1''', atnam(2) = 'H4''', r1 = 2.350, r2 = 3.350, r3 = 4.370, r4 = 5.370, rk2 =10.000, rk3 =10.000, &end # distance restraint # 181 &rst iresid = 1, iat = 17, 16, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 1.690, r2 = 2.690, r3 = 6.120, r4 = 7.120, rk2 =10.000, rk3 =10.000, &end # distance restraint # 182 &rst iresid = 1, iat = 17, 16, atnam(1) = 'H6', atnam(2) = 'H3''', r1 = 1.900, r2 = 2.900, r3 = 4.640, r4 = 5.640, rk2 =10.000, rk3 =10.000, &end # distance restraint # 183 &rst iresid = 1, iat = 17, 16, atnam(1) = 'H6', atnam(2) = 'H2'1'', r1 = 1.740, r2 = 2.740, r3 = 5.190, r4 = 6.190, rk2 =10.000, rk3 =10.000, &end # distance restraint # 184 &rst iresid = 1, iat = 17, 17, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 1.550, r2 = 2.550, r3 = 5.170, r4 = 6.170, rk2 =10.000, rk3 =10.000, &end # distance restraint # 185 &rst iresid = 1, iat = 17, 16, atnam(1) = 'H5', atnam(2) = 'H6', r1 = 2.640, r2 = 3.640, r3 = 5.420, r4 = 6.420, rk2 =10.000, rk3 =10.000, &end # distance restraint # 186 &rst iresid = 1, iat = 17, 16, atnam(1) = 'H5', atnam(2) = 'H5', r1 = 2.680, r2 = 3.680, r3 = 5.210, r4 = 6.210, rk2 =10.000, rk3 =10.000, &end # distance restraint # 187 &rst iresid = 1, iat = 17, 16, atnam(1) = 'H5', atnam(2) = 'H3''', r1 = 2.620, r2 = 3.620, r3 = 5.860, r4 = 6.860, rk2 =10.000, rk3 =10.000, &end # distance restraint # 188 &rst iresid = 1, iat = 17, 17, atnam(1) = 'H5', atnam(2) = 'H1''', r1 = 2.520, r2 = 3.520, r3 = 6.790, r4 = 7.790, rk2 =10.000, rk3 =10.000, &end # distance restraint # 189 &rst iresid = 1, iat = 17, 17, atnam(1) = 'H5', atnam(2) = 'H6', r1 = 2.430, r2 = 3.430, r3 = 5.720, r4 = 6.720, rk2 =10.000, rk3 =10.000, &end # distance restraint # 190 &rst iresid = 1, iat = 17, 17, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 2.100, r2 = 3.100, r3 = 5.770, r4 = 6.770, rk2 =10.000, rk3 =10.000, &end # distance restraint # 191 &rst iresid = 1, iat = 17, 17, atnam(1) = 'H3''', atnam(2) = 'H6', r1 = 1.600, r2 = 2.600, r3 = 3.730, r4 = 4.730, rk2 =10.000, rk3 =10.000, &end # distance restraint # 192 &rst iresid = 1, iat = 17, 17, atnam(1) = 'H2'1'', atnam(2) = 'H1''', r1 = 3.470, r2 = 4.470, r3 = 7.050, r4 = 8.050, rk2 =10.000, rk3 =10.000, &end # distance restraint # 193 &rst iresid = 1, iat = 17, 17, atnam(1) = 'H2'1'', atnam(2) = 'H5', r1 = 1.280, r2 = 2.280, r3 = 2.480, r4 = 3.480, rk2 =10.000, rk3 =10.000, &end # distance restraint # 194 &rst iresid = 1, iat = 18, 2, atnam(1) = 'H1''', atnam(2) = 'H2', r1 = 3.060, r2 = 4.060, r3 = 5.900, r4 = 6.900, rk2 =10.000, rk3 =10.000, &end # distance restraint # 195 &rst iresid = 1, iat = 18, 17, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 2.000, r2 = 3.000, r3 = 5.590, r4 = 6.590, rk2 =10.000, rk3 =10.000, &end # distance restraint # 196 &rst iresid = 1, iat = 18, 17, atnam(1) = 'H6', atnam(2) = 'H6', r1 = 1.210, r2 = 2.210, r3 = 2.690, r4 = 3.690, rk2 =10.000, rk3 =10.000, &end # distance restraint # 197 &rst iresid = 1, iat = 18, 17, atnam(1) = 'H6', atnam(2) = 'H3''', r1 = 1.490, r2 = 2.490, r3 = 2.930, r4 = 3.930, rk2 =10.000, rk3 =10.000, &end # distance restraint # 198 &rst iresid = 1, iat = 18, 17, atnam(1) = 'H6', atnam(2) = 'H2'1'', r1 = 1.820, r2 = 2.820, r3 = 3.410, r4 = 4.410, rk2 =10.000, rk3 =10.000, &end # distance restraint # 199 &rst iresid = 1, iat = 18, 18, atnam(1) = 'H6', atnam(2) = 'H1''', r1 = 2.740, r2 = 3.740, r3 = 7.100, r4 = 8.100, rk2 =10.000, rk3 =10.000, &end # distance restraint # 200 &rst iresid = 1, iat = 18, 18, atnam(1) = 'H5', atnam(2) = 'H6', r1 = 3.240, r2 = 4.240, r3 = 5.590, r4 = 6.590, rk2 =10.000, rk3 =10.000, &end # distance restraint # 201 &rst iresid = 1, iat = 18, 18, atnam(1) = 'H3''', atnam(2) = 'H1''', r1 = 1.880, r2 = 2.880, r3 = 3.700, r4 = 4.700, rk2 =10.000, rk3 =10.000, &end # distance restraint # 202 &rst iresid = 1, iat = 18, 18, atnam(1) = 'H3''', atnam(2) = 'H6', r1 = 1.460, r2 = 2.460, r3 = 3.750, r4 = 4.750, rk2 =10.000, rk3 =10.000, &end # distance restraint # 203 &rst iresid = 1, iat = 18, 18, atnam(1) = 'H2'1'', atnam(2) = 'H6', r1 = 1.930, r2 = 2.930, r3 = 4.930, r4 = 5.930, rk2 =10.000, rk3 =10.000, &end # distance restraint # 204 &rst iresid = 1, iat = 18, 18, atnam(1) = 'H2'1'', atnam(2) = 'H5', r1 = 2.820, r2 = 3.820, r3 = 5.660, r4 = 6.660, rk2 =10.000, rk3 =10.000, &end # 572 atoms read from pdb file BD_34.pdb. # 2 ADE NU0: (2 A C4')-(2 A O4')-(2 A C1')-(2 A C2') -13.0 17.0 &rst iat = 40, 42, 43, 61, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, rk2 = 2.0, rk3 = 2.0, &end # 2 ADE NU1: (2 A O4')-(2 A C1')-(2 A C2')-(2 A C3') -38.4 -8.4 &rst iat = 42, 43, 61, 59, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 2 ADE NU2: (2 A C1')-(2 A C2')-(2 A C3')-(2 A C4') 20.9 50.9 &rst iat = 43, 61, 59, 40, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 2 ADE NU3: (2 A C2')-(2 A C3')-(2 A C4')-(2 A O4') -49.7 -19.7 &rst iat = 61, 59, 40, 42, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 2 ADE NU4: (2 A C3')-(2 A C4')-(2 A O4')-(2 A C1') 5.3 35.3 &rst iat = 59, 40, 42, 43, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 4 CYT NU0: (4 C C4')-(4 C O4')-(4 C C1')-(4 C C2') -13.0 17.0 &rst iat = 103, 105, 106, 122, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 4 CYT NU1: (4 C O4')-(4 C C1')-(4 C C2')-(4 C C3') -38.4 -8.4 &rst iat = 105, 106, 122, 120, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 4 CYT NU2: (4 C C1')-(4 C C2')-(4 C C3')-(4 C C4') 20.9 50.9 &rst iat = 106, 122, 120, 103, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 4 CYT NU3: (4 C C2')-(4 C C3')-(4 C C4')-(4 C O4') -49.7 -19.7 &rst iat = 122, 120, 103, 105, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 4 CYT NU4: (4 C C3')-(4 C C4')-(4 C O4')-(4 C C1') 5.3 35.3 &rst iat = 120, 103, 105, 106, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 5 ADE NU0: (5 A C4')-(5 A O4')-(5 A C1')-(5 A C2') -13.0 17.0 &rst iat = 134, 136, 137, 155, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 5 ADE NU1: (5 A O4')-(5 A C1')-(5 A C2')-(5 A C3') -38.4 -8.4 &rst iat = 136, 137, 155, 153, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 5 ADE NU2: (5 A C1')-(5 A C2')-(5 A C3')-(5 A C4') 20.9 50.9 &rst iat = 137, 155, 153, 134, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 5 ADE NU3: (5 A C2')-(5 A C3')-(5 A C4')-(5 A O4') -49.7 -19.7 &rst iat = 155, 153, 134, 136, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 5 ADE NU4: (5 A C3')-(5 A C4')-(5 A O4')-(5 A C1') 5.3 35.3 &rst iat = 153, 134, 136, 137, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 6 CYT NU0: (6 C C4')-(6 C O4')-(6 C C1')-(6 C C2') -13.0 17.0 &rst iat = 167, 169, 170, 186, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 6 CYT NU1: (6 C O4')-(6 C C1')-(6 C C2')-(6 C C3') -38.4 -8.4 &rst iat = 169, 170, 186, 184, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 6 CYT NU2: (6 C C1')-(6 C C2')-(6 C C3')-(6 C C4') 20.9 50.9 &rst iat = 170, 186, 184, 167, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 6 CYT NU3: (6 C C2')-(6 C C3')-(6 C C4')-(6 C O4') -49.7 -19.7 &rst iat = 186, 184, 167, 169, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 6 CYT NU4: (6 C C3')-(6 C C4')-(6 C O4')-(6 C C1') 5.3 35.3 &rst iat = 184, 167, 169, 170, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 7 CYT NU0: (7 C C4')-(7 C O4')-(7 C C1')-(7 C C2') -13.0 17.0 &rst iat = 198, 200, 201, 217, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 7 CYT NU1: (7 C O4')-(7 C C1')-(7 C C2')-(7 C C3') -38.4 -8.4 &rst iat = 200, 201, 217, 215, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 7 CYT NU2: (7 C C1')-(7 C C2')-(7 C C3')-(7 C C4') 20.9 50.9 &rst iat = 201, 217, 215, 198, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 7 CYT NU3: (7 C C2')-(7 C C3')-(7 C C4')-(7 C O4') -49.7 -19.7 &rst iat = 217, 215, 198, 200, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 7 CYT NU4: (7 C C3')-(7 C C4')-(7 C O4')-(7 C C1') 5.3 35.3 &rst iat = 215, 198, 200, 201, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 8 URA NU0: (8 U C4')-(8 U O4')-(8 U C1')-(8 U C2') -13.0 17.0 &rst iat = 229, 231, 232, 247, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 8 URA NU1: (8 U O4')-(8 U C1')-(8 U C2')-(8 U C3') -38.4 -8.4 &rst iat = 231, 232, 247, 245, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 8 URA NU2: (8 U C1')-(8 U C2')-(8 U C3')-(8 U C4') 20.9 50.9 &rst iat = 232, 247, 245, 229, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 8 URA NU3: (8 U C2')-(8 U C3')-(8 U C4')-(8 U O4') -49.7 -19.7 &rst iat = 247, 245, 229, 231, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 8 URA NU4: (8 U C3')-(8 U C4')-(8 U O4')-(8 U C1') 5.3 35.3 &rst iat = 245, 229, 231, 232, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 10 CYT NU0: (10 C C4')-(10 C O4')-(10 C C1')-(10 C C2') -13.0 17.0 &rst iat = 295, 297, 298, 314, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 10 CYT NU1: (10 C O4')-(10 C C1')-(10 C C2')-(10 C C3') -38.4 -8.4 &rst iat = 297, 298, 314, 312, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 10 CYT NU2: (10 C C1')-(10 C C2')-(10 C C3')-(10 C C4') 20.9 50.9 &rst iat = 298, 314, 312, 295, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 10 CYT NU3: (10 C C2')-(10 C C3')-(10 C C4')-(10 C O4') -49.7 -19.7 &rst iat = 314, 312, 295, 297, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 10 CYT NU4: (10 C C3')-(10 C C4')-(10 C O4')-(10 C C1') 5.3 35.3 &rst iat = 312, 295, 297, 298, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 11 ADE NU0: (11 A C4')-(11 A O4')-(11 A C1')-(11 A C2') -13.0 17.0 &rst iat = 326, 328, 329, 347, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 11 ADE NU1: (11 A O4')-(11 A C1')-(11 A C2')-(11 A C3') -38.4 -8.4 &rst iat = 328, 329, 347, 345, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 11 ADE NU2: (11 A C1')-(11 A C2')-(11 A C3')-(11 A C4') 20.9 50.9 &rst iat = 329, 347, 345, 326, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 11 ADE NU3: (11 A C2')-(11 A C3')-(11 A C4')-(11 A O4') -49.7 -19.7 &rst iat = 347, 345, 326, 328, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 11 ADE NU4: (11 A C3')-(11 A C4')-(11 A O4')-(11 A C1') 5.3 35.3 &rst iat = 345, 326, 328, 329, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 12 GUA NU0: (12 G C4')-(12 G O4')-(12 G C1')-(12 G C2') -13.0 17.0 &rst iat = 359, 361, 362, 381, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 12 GUA NU1: (12 G O4')-(12 G C1')-(12 G C2')-(12 G C3') -38.4 -8.4 &rst iat = 361, 362, 381, 379, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 12 GUA NU2: (12 G C1')-(12 G C2')-(12 G C3')-(12 G C4') 20.9 50.9 &rst iat = 362, 381, 379, 359, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 12 GUA NU3: (12 G C2')-(12 G C3')-(12 G C4')-(12 G O4') -49.7 -19.7 &rst iat = 381, 379, 359, 361, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 12 GUA NU4: (12 G C3')-(12 G C4')-(12 G O4')-(12 G C1') 5.3 35.3 &rst iat = 379, 359, 361, 362, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 13 GUA NU0: (13 G C4')-(13 G O4')-(13 G C1')-(13 G C2') -13.0 17.0 &rst iat = 393, 395, 396, 415, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 13 GUA NU1: (13 G O4')-(13 G C1')-(13 G C2')-(13 G C3') -38.4 -8.4 &rst iat = 395, 396, 415, 413, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 13 GUA NU2: (13 G C1')-(13 G C2')-(13 G C3')-(13 G C4') 20.9 50.9 &rst iat = 396, 415, 413, 393, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 13 GUA NU3: (13 G C2')-(13 G C3')-(13 G C4')-(13 G O4') -49.7 -19.7 &rst iat = 415, 413, 393, 395, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 13 GUA NU4: (13 G C3')-(13 G C4')-(13 G O4')-(13 G C1') 5.3 35.3 &rst iat = 413, 393, 395, 396, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 14 URA NU0: (14 U C4')-(14 U O4')-(14 U C1')-(14 U C2') -13.0 17.0 &rst iat = 427, 429, 430, 445, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 14 URA NU1: (14 U O4')-(14 U C1')-(14 U C2')-(14 U C3') -38.4 -8.4 &rst iat = 429, 430, 445, 443, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 14 URA NU2: (14 U C1')-(14 U C2')-(14 U C3')-(14 U C4') 20.9 50.9 &rst iat = 430, 445, 443, 427, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 14 URA NU3: (14 U C2')-(14 U C3')-(14 U C4')-(14 U O4') -49.7 -19.7 &rst iat = 445, 443, 427, 429, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 14 URA NU4: (14 U C3')-(14 U C4')-(14 U O4')-(14 U C1') 5.3 35.3 &rst iat = 443, 427, 429, 430, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 15 GUA NU0: (15 G C4')-(15 G O4')-(15 G C1')-(15 G C2') -13.0 17.0 &rst iat = 457, 459, 460, 479, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 15 GUA NU1: (15 G O4')-(15 G C1')-(15 G C2')-(15 G C3') -38.4 -8.4 &rst iat = 459, 460, 479, 477, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 15 GUA NU2: (15 G C1')-(15 G C2')-(15 G C3')-(15 G C4') 20.9 50.9 &rst iat = 460, 479, 477, 457, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 15 GUA NU3: (15 G C2')-(15 G C3')-(15 G C4')-(15 G O4') -49.7 -19.7 &rst iat = 479, 477, 457, 459, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 15 GUA NU4: (15 G C3')-(15 G C4')-(15 G O4')-(15 G C1') 5.3 35.3 &rst iat = 477, 457, 459, 460, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 17 URA NU0: (17 U C4')-(17 U O4')-(17 U C1')-(17 U C2') -13.0 17.0 &rst iat = 521, 523, 524, 539, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 17 URA NU1: (17 U O4')-(17 U C1')-(17 U C2')-(17 U C3') -38.4 -8.4 &rst iat = 523, 524, 539, 537, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 17 URA NU2: (17 U C1')-(17 U C2')-(17 U C3')-(17 U C4') 20.9 50.9 &rst iat = 524, 539, 537, 521, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 17 URA NU3: (17 U C2')-(17 U C3')-(17 U C4')-(17 U O4') -49.7 -19.7 &rst iat = 539, 537, 521, 523, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 17 URA NU4: (17 U C3')-(17 U C4')-(17 U O4')-(17 U C1') 5.3 35.3 &rst iat = 537, 521, 523, 524, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # 17 URA NU0: (17 U C4')-(17 U O4')-(17 U C1')-(17 U C2') -13.0 17.0 &rst iat = 521, 523, 524, 539, r1 = -14.0, r2 = -13.0, r3 = 17.0, r4 = 18.0, &end # 17 URA NU1: (17 U O4')-(17 U C1')-(17 U C2')-(17 U C3') -38.4 -8.4 &rst iat = 523, 524, 539, 537, r1 = -39.4, r2 = -38.4, r3 = -8.4, r4 = -7.4, &end # 17 URA NU2: (17 U C1')-(17 U C2')-(17 U C3')-(17 U C4') 20.9 50.9 &rst iat = 524, 539, 537, 521, r1 = 19.9, r2 = 20.9, r3 = 50.9, r4 = 51.9, &end # 17 URA NU3: (17 U C2')-(17 U C3')-(17 U C4')-(17 U O4') -49.7 -19.7 &rst iat = 539, 537, 521, 523, r1 = -50.7, r2 = -49.7, r3 = -19.7, r4 = -18.7, &end # 17 URA NU4: (17 U C3')-(17 U C4')-(17 U O4')-(17 U C1') 5.3 35.3 &rst iat = 537, 521, 523, 524, r1 = 4.3, r2 = 5.3, r3 = 35.3, r4 = 36.3, &end # # 1 GUA H22 18 CYT O2 1.75 1.95\ &rst ixpk= 0, nxpk= 0, iat= 23, 564, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45, rk2=20.0, rk3=20.0, ir6=1, ialtd=0, &end # # 1 GUA N1 18 CYT N3 2.85 3.05\ &rst ixpk= 0, nxpk= 0, iat= 18, 562, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, &end # # 1 GUA O6 18 CYT H42 1.80 2.00\ &rst ixpk= 0, nxpk= 0, iat= 17, 561, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 1 GUA O6 18 CYT N4 2.81 3.01\ &rst ixpk= 0, nxpk= 0, iat= 17, 559, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51, &end # # 2 ADE H61 17 URI O4 1.84 2.04\ &rst ixpk= 0, nxpk= 0, iat= 52, 529, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end # # 2 ADE N1 17 URI H3 1.71 1.91\ &rst ixpk= 0, nxpk= 0, iat= 54, 531, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41, &end # # 2 ADE N1 17 URI N3 2.72 2.92\ &rst ixpk= 0, nxpk= 0, iat= 54, 530, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42, &end # # 4 CYT N3 15 GUA H1 1.84 2.04\ &rst ixpk= 0, nxpk= 0, iat= 117, 467, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end # # 4 CYT N3 15 GUA N1 2.85 3.05\ &rst ixpk= 0, nxpk= 0, iat= 117, 466, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, &end # # 4 CYT N4 15 GUA O6 2.81 3.01\ &rst ixpk= 0, nxpk= 0, iat= 114, 465, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51, &end # # 4 CYT O2 15 GUA H22 1.75 1.95\ &rst ixpk= 0, nxpk= 0, iat= 119, 471, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45, &end # # 5 ADE H61 14 URI O4 1.84 2.04\ &rst ixpk= 0, nxpk= 0, iat= 146, 435, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end # # 5 ADE N1 14 URI H3 1.71 1.91\ &rst ixpk= 0, nxpk= 0, iat= 148, 437, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41, &end # # 5 ADE N1 14 URI N3 2.72 2.92\ &rst ixpk= 0, nxpk= 0, iat= 148, 436, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42, &end # # 6 CYT N3 13 GUA H1 1.84 2.04\ &rst ixpk= 0, nxpk= 0, iat= 181, 403, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end # # 6 CYT N3 13 GUA N1 2.85 3.05\ &rst ixpk= 0, nxpk= 0, iat= 181, 402, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, &end # # 6 CYT N4 13 GUA O6 2.81 3.01\ &rst ixpk= 0, nxpk= 0, iat= 178, 401, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51, &end # # 6 CYT O2 13 GUA H22 1.75 1.95\ &rst ixpk= 0, nxpk= 0, iat= 183, 407, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45, &end # # 7 CYT N3 12 GUA H1 1.84 2.04\ &rst ixpk= 0, nxpk= 0, iat= 212, 369, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end # # 7 CYT N3 12 GUA N1 2.85 3.05\ &rst ixpk= 0, nxpk= 0, iat= 212, 368, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, &end # # 7 CYT N4 12 GUA O6 2.81 3.01\ &rst ixpk= 0, nxpk= 0, iat= 209, 367, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51, &end # # 7 CYT O2 12 GUA H22 1.75 1.95\ &rst ixpk= 0, nxpk= 0, iat= 214, 373, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45, &end # # 8 URI H3 11 ADE N1 1.71 1.91\ &rst ixpk= 0, nxpk= 0, iat= 242, 337, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41, &end # # 8 URI N3 11 ADE N1 2.72 2.92\ &rst ixpk= 0, nxpk= 0, iat= 241, 337, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42, &end # # 8 URI O4 11 ADE H61 1.84 2.04\ &rst ixpk= 0, nxpk= 0, iat= 240, 335, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end # # 9 GUA H1 10 CYT N3 1.84 2.04\ &rst ixpk= 0, nxpk= 0, iat= 272, 306, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end # # 9 GUA H22 10 CYT O2 1.75 1.95\ &rst ixpk= 0, nxpk= 0, iat= 276, 308, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45, &end # # 9 GUA N1 10 CYT N3 2.85 3.05\ &rst ixpk= 0, nxpk= 0, iat= 271, 306, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, &end # # 9 GUA O6 10 CYT H42 1.80 2.00\ &rst ixpk= 0, nxpk= 0, iat= 270, 305, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end # # 9 GUA O6 10 CYT N4 2.81 3.01} &rst ixpk= 0, nxpk= 0, iat= 270, 303, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51, &end # 2 ADE ALPHA: (1 RG5 O3')-(2 RC P)-(2 RC O5')-(2 RC C5') -155.0 25.0 &rst iat = 32, 33, 36, 37, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, rk2 = 2.0, rk3 = 2.0, &end # 3 URA ALPHA: (2 RC O3')-(3 RG P)-(3 RG O5')-(3 RG C5') -155.0 25.0 &rst iat = 63, 64, 67, 68, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 4 CYT ALPHA: (3 RG O3')-(4 RU P)-(4 RU O5')-(4 RU C5') -155.0 25.0 &rst iat = 97, 98, 101, 102, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 5 ADE ALPHA: (4 RU O3')-(5 RA P)-(5 RA O5')-(5 RA C5') -155.0 25.0 &rst iat = 127, 128, 131, 132, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 6 CYT ALPHA: (5 RA O3')-(6 RC P)-(6 RC O5')-(6 RC C5') -155.0 25.0 &rst iat = 160, 161, 164, 165, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 7 CYT ALPHA: (6 RC O3')-(7 RG P)-(7 RG O5')-(7 RG C5') -155.0 25.0 &rst iat = 191, 192, 195, 196, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 8 URA ALPHA: (7 RG O3')-(8 RC3 P)-(8 RC3 O5')-(8 RC3 C5') -155.0 25.0 &rst iat = 225, 226, 229, 230, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 9 GUA ALPHA: (9 RG5 O3')-(10 RC P)-(10 RC O5')-(10 RC C5') -155.0 25.0 &rst iat = 289, 290, 293, 294, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 11 ADE ALPHA: (10 RC O3')-(11 RG P)-(11 RG O5')-(11 RG C5') -155.0 25.0 &rst iat = 320, 321, 324, 325, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 12 GUA ALPHA: (11 RG O3')-(12 RU P)-(12 RU O5')-(12 RU C5') -155.0 25.0 &rst iat = 354, 355, 358, 359, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 13 GUA ALPHA: (12 RU O3')-(13 RA P)-(13 RA O5')-(13 RA C5') -155.0 25.0 &rst iat = 384, 385, 388, 389, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 14 URA ALPHA: (13 RA O3')-(14 RC P)-(14 RC O5')-(14 RC C5') -155.0 25.0 &rst iat = 417, 418, 421, 422, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 15 GUA ALPHA: (14 RC O3')-(15 RG P)-(15 RG O5')-(15 RG C5') -155.0 25.0 &rst iat = 448, 449, 452, 453, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 16 URA ALPHA: (15 RG O3')-(16 RC3 P)-(16 RC3 O5')-(16 RC3 C5') -155.0 25.0 &rst iat = 482, 483, 486, 487, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 17 URA ALPHA: (10 RC O3')-(11 RG P)-(11 RG O5')-(11 RG C5') -155.0 25.0 &rst iat = 320, 321, 324, 325, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 18 CYT ALPHA: (10 RC O3')-(11 RG P)-(11 RG O5')-(11 RG C5') -155.0 25.0 &rst iat = 320, 321, 324, 325, r1 = -156.0, r2 = -155.0, r3 = 25.0, r4 = 26.0, &end # 1 GUA BETA: (2 RC P)-(1 RG5 O5')-(1 RG5 C5')-(1 RG5 C4') 90.0 240.0 &rst iat = 33, 2, 3, 6, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 2 ADE BETA: (2 RC P)-(2 RC O5')-(2 RC C5')-(2 RC C4') 90.0 240.0 &rst iat = 33, 36, 37, 40, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 3 URA BETA: (3 RG P)-(3 RG O5')-(3 RG C5')-(3 RG C4') 90.0 240.0 &rst iat = 64, 67, 68, 71, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 4 CYT BETA: (4 RU P)-(4 RU O5')-(4 RU C5')-(4 RU C4') 90.0 240.0 &rst iat = 98, 101, 102, 105, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 5 ADE BETA: (5 RA P)-(5 RA O5')-(5 RA C5')-(5 RA C4') 90.0 240.0 &rst iat = 128, 131, 132, 135, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 6 CYT BETA: (6 RC P)-(6 RC O5')-(6 RC C5')-(6 RC C4') 90.0 240.0 &rst iat = 161, 164, 165, 168, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 7 CYT BETA: (7 RG P)-(7 RG O5')-(7 RG C5')-(7 RG C4') 90.0 240.0 &rst iat = 192, 195, 196, 199, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 8 URA BETA: (8 RC3 P)-(8 RC3 O5')-(8 RC3 C5')-(8 RC3 C4') 90.0 240.0 &rst iat = 226, 229, 230, 233, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 9 GUA BETA: (10 RC P)-(9 RG5 O5')-(9 RG5 C5')-(9 RG5 C4') 90.0 240.0 &rst iat = 290, 259, 260, 263, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 10 CYT BETA: (10 RC P)-(10 RC O5')-(10 RC C5')-(10 RC C4') 90.0 240.0 &rst iat = 290, 293, 294, 297, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 11 ADE BETA: (11 RG P)-(11 RG O5')-(11 RG C5')-(11 RG C4') 90.0 240.0 &rst iat = 321, 324, 325, 328, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 12 GUA BETA: (12 RU P)-(12 RU O5')-(12 RU C5')-(12 RU C4') 90.0 240.0 &rst iat = 355, 358, 359, 362, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 13 GUA BETA: (13 RA P)-(13 RA O5')-(13 RA C5')-(13 RA C4') 90.0 240.0 &rst iat = 385, 388, 389, 392, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 14 URA BETA: (14 RC P)-(14 RC O5')-(14 RC C5')-(14 RC C4') 90.0 240.0 &rst iat = 418, 421, 422, 425, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 15 GUA BETA: (15 RG P)-(15 RG O5')-(15 RG C5')-(15 RG C4') 90.0 240.0 &rst iat = 449, 452, 453, 456, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 16 URA BETA: (16 RC3 P)-(16 RC3 O5')-(16 RC3 C5')-(16 RC3 C4') 90.0 240.0 &rst iat = 483, 486, 487, 490, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 17 URA BETA: (16 RC3 P)-(16 RC3 O5')-(16 RC3 C5')-(16 RC3 C4') 90.0 240.0 &rst iat = 483, 486, 487, 490, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 18 CYT BETA: (16 RC3 P)-(16 RC3 O5')-(16 RC3 C5')-(16 RC3 C4') 90.0 240.0 &rst iat = 483, 486, 487, 490, r1 = 89.0, r2 = 90.0, r3 = 240.0, r4 = 241.0, &end # 1 GUA GAMMA: (1 RG5 O5')-(1 RG5 C5')-(1 RG5 C4')-(1 RG5 C3') 0.0 120.0 &rst iat = 2, 3, 6, 26, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 2 ADE GAMMA: (2 RC O5')-(2 RC C5')-(2 RC C4')-(2 RC C3') 0.0 120.0 &rst iat = 36, 37, 40, 57, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 3 URA GAMMA: (3 RG O5')-(3 RG C5')-(3 RG C4')-(3 RG C3') 0.0 120.0 &rst iat = 67, 68, 71, 91, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 4 CYT GAMMA: (4 RU O5')-(4 RU C5')-(4 RU C4')-(4 RU C3') 0.0 120.0 &rst iat = 101, 102, 105, 121, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 5 ADE GAMMA: (5 RA O5')-(5 RA C5')-(5 RA C4')-(5 RA C3') 0.0 120.0 &rst iat = 131, 132, 135, 154, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 6 CYT GAMMA: (6 RC O5')-(6 RC C5')-(6 RC C4')-(6 RC C3') 0.0 120.0 &rst iat = 164, 165, 168, 185, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 7 CYT GAMMA: (7 RG O5')-(7 RG C5')-(7 RG C4')-(7 RG C3') 0.0 120.0 &rst iat = 195, 196, 199, 219, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 8 URA GAMMA: (8 RC3 O5')-(8 RC3 C5')-(8 RC3 C4')-(8 RC3 C3') 0.0 120.0 &rst iat = 229, 230, 233, 250, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 9 GUA GAMMA: (9 RG5 O5')-(9 RG5 C5')-(9 RG5 C4')-(9 RG5 C3') 0.0 120.0 &rst iat = 259, 260, 263, 283, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 10 CYT GAMMA: (10 RC O5')-(10 RC C5')-(10 RC C4')-(10 RC C3') 0.0 120.0 &rst iat = 293, 294, 297, 314, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 11 ADE GAMMA: (11 RG O5')-(11 RG C5')-(11 RG C4')-(11 RG C3') 0.0 120.0 &rst iat = 324, 325, 328, 348, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 12 GUA GAMMA: (12 RU O5')-(12 RU C5')-(12 RU C4')-(12 RU C3') 0.0 120.0 &rst iat = 358, 359, 362, 378, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 13 GUA GAMMA: (13 RA O5')-(13 RA C5')-(13 RA C4')-(13 RA C3') 0.0 120.0 &rst iat = 388, 389, 392, 411, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 14 URA GAMMA: (14 RC O5')-(14 RC C5')-(14 RC C4')-(14 RC C3') 0.0 120.0 &rst iat = 421, 422, 425, 442, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 15 GUA GAMMA: (15 RG O5')-(15 RG C5')-(15 RG C4')-(15 RG C3') 0.0 120.0 &rst iat = 452, 453, 456, 476, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 16 URA GAMMA: (16 RC3 O5')-(16 RC3 C5')-(16 RC3 C4')-(16 RC3 C3') 0.0 120.0 &rst iat = 486, 487, 490, 507, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 17 URA GAMMA: (16 RC3 O5')-(16 RC3 C5')-(16 RC3 C4')-(16 RC3 C3') 0.0 120.0 &rst iat = 486, 487, 490, 507, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 18 CYT GAMMA: (16 RC3 O5')-(16 RC3 C5')-(16 RC3 C4')-(16 RC3 C3') 0.0 120.0 &rst iat = 486, 487, 490, 507, r1 = -1.0, r2 = 0.0, r3 = 120.0, r4 = 121.0, &end # 1 GUA DELTA: (1 RG5 C5')-(1 RG5 C4')-(1 RG5 C3')-(1 RG5 O3') 45.0 115.0 &rst iat = 3, 6, 26, 32, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 2 ADE DELTA: (2 RC C5')-(2 RC C4')-(2 RC C3')-(2 RC O3') 45.0 115.0 &rst iat = 37, 40, 57, 63, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 3 URA DELTA: (3 RG C5')-(3 RG C4')-(3 RG C3')-(3 RG O3') 45.0 115.0 &rst iat = 68, 71, 91, 97, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 4 CYT DELTA: (4 RU C5')-(4 RU C4')-(4 RU C3')-(4 RU O3') 45.0 115.0 &rst iat = 102, 105, 121, 127, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 5 ADE DELTA: (5 RA C5')-(5 RA C4')-(5 RA C3')-(5 RA O3') 45.0 115.0 &rst iat = 132, 135, 154, 160, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 6 CYT DELTA: (6 RC C5')-(6 RC C4')-(6 RC C3')-(6 RC O3') 45.0 115.0 &rst iat = 165, 168, 185, 191, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 7 CYT DELTA: (7 RG C5')-(7 RG C4')-(7 RG C3')-(7 RG O3') 45.0 115.0 &rst iat = 196, 199, 219, 225, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 8 URA DELTA: (8 RC3 C5')-(8 RC3 C4')-(8 RC3 C3')-(8 RC3 O3') 45.0 115.0 &rst iat = 230, 233, 250, 256, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 9 GUA DELTA: (9 RG5 C5')-(9 RG5 C4')-(9 RG5 C3')-(9 RG5 O3') 45.0 115.0 &rst iat = 260, 263, 283, 289, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 10 CYT DELTA: (10 RC C5')-(10 RC C4')-(10 RC C3')-(10 RC O3') 45.0 115.0 &rst iat = 294, 297, 314, 320, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 11 ADE DELTA: (11 RG C5')-(11 RG C4')-(11 RG C3')-(11 RG O3') 45.0 115.0 &rst iat = 325, 328, 348, 354, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 12 GUA DELTA: (12 RU C5')-(12 RU C4')-(12 RU C3')-(12 RU O3') 45.0 115.0 &rst iat = 359, 362, 378, 384, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 13 GUA DELTA: (13 RA C5')-(13 RA C4')-(13 RA C3')-(13 RA O3') 45.0 115.0 &rst iat = 389, 392, 411, 417, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 14 URA DELTA: (14 RC C5')-(14 RC C4')-(14 RC C3')-(14 RC O3') 45.0 115.0 &rst iat = 422, 425, 442, 448, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 15 GUA DELTA: (15 RG C5')-(15 RG C4')-(15 RG C3')-(15 RG O3') 45.0 115.0 &rst iat = 453, 456, 476, 482, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 16 URA DELTA: (16 RC3 C5')-(16 RC3 C4')-(16 RC3 C3')-(16 RC3 O3') 45.0 115.0 &rst iat = 487, 490, 507, 513, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 17 URA DELTA: (16 RC3 C5')-(16 RC3 C4')-(16 RC3 C3')-(16 RC3 O3') 45.0 115.0 &rst iat = 487, 490, 507, 513, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 18 CYT DELTA: (16 RC3 C5')-(16 RC3 C4')-(16 RC3 C3')-(16 RC3 O3') 45.0 115.0 &rst iat = 487, 490, 507, 513, r1 = 44.0, r2 = 45.0, r3 = 115.0, r4 = 116.0, &end # 1 GUA EPSILN: (1 RG5 C4')-(1 RG5 C3')-(1 RG5 O3')-(2 RC P) -240.0 10.0 &rst iat = 6, 26, 32, 33, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 2 ADE EPSILN: (2 RC C4')-(2 RC C3')-(2 RC O3')-(3 RG P) -240.0 10.0 &rst iat = 40, 57, 63, 64, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 3 URA EPSILN: (3 RG C4')-(3 RG C3')-(3 RG O3')-(4 RU P) -240.0 10.0 &rst iat = 71, 91, 97, 98, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 4 CYT EPSILN: (4 RU C4')-(4 RU C3')-(4 RU O3')-(5 RA P) -240.0 10.0 &rst iat = 105, 121, 127, 128, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 5 ADE EPSILN: (5 RA C4')-(5 RA C3')-(5 RA O3')-(6 RC P) -240.0 10.0 &rst iat = 135, 154, 160, 161, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 6 CYT EPSILN: (6 RC C4')-(6 RC C3')-(6 RC O3')-(7 RG P) -240.0 10.0 &rst iat = 168, 185, 191, 192, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 7 CYT EPSILN: (7 RG C4')-(7 RG C3')-(7 RG O3')-(8 RC3 P) -240.0 10.0 &rst iat = 199, 219, 225, 226, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 8 URA EPSILN: (9 RG5 C4')-(9 RG5 C3')-(9 RG5 O3')-(10 RC P) -240.0 10.0 &rst iat = 263, 283, 289, 290, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 9 GUA EPSILN: (9 RG5 C4')-(9 RG5 C3')-(9 RG5 O3')-(10 RC P) -240.0 10.0 &rst iat = 263, 283, 289, 290, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 10 CYT EPSILN: (10 RC C4')-(10 RC C3')-(10 RC O3')-(11 RG P) -240.0 10.0 &rst iat = 297, 314, 320, 321, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 11 ADE EPSILN: (11 RG C4')-(11 RG C3')-(11 RG O3')-(12 RU P) -240.0 10.0 &rst iat = 328, 348, 354, 355, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 12 GUA EPSILN: (12 RU C4')-(12 RU C3')-(12 RU O3')-(13 RA P) -240.0 10.0 &rst iat = 362, 378, 384, 385, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 13 GUA EPSILN: (13 RA C4')-(13 RA C3')-(13 RA O3')-(14 RC P) -240.0 10.0 &rst iat = 392, 411, 417, 418, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 14 URA EPSILN: (14 RC C4')-(14 RC C3')-(14 RC O3')-(15 RG P) -240.0 10.0 &rst iat = 425, 442, 448, 449, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 15 GUA EPSILN: (15 RG C4')-(15 RG C3')-(15 RG O3')-(16 RC3 P) -240.0 10.0 &rst iat = 456, 476, 482, 483, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 16 URA EPSILN: (15 RG C4')-(15 RG C3')-(15 RG O3')-(16 RC3 P) -240.0 10.0 &rst iat = 456, 476, 482, 483, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 17 URA EPSILN: (15 RG C4')-(15 RG C3')-(15 RG O3')-(16 RC3 P) -240.0 10.0 &rst iat = 456, 476, 482, 483, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 18 CYT EPSILN: (15 RG C4')-(15 RG C3')-(15 RG O3')-(16 RC3 P) -240.0 10.0 &rst iat = 456, 476, 482, 483, r1 = -241.0, r2 = -240.0, r3 = 10.0, r4 = 11.0, &end # 1 GUA ZETA: (1 RG5 C3')-(1 RG5 O3')-(2 RC P)-(2 RC O5') -160.0 20.0 &rst iat = 26, 32, 33, 36, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 2 ADE ZETA: (2 RC C3')-(2 RC O3')-(3 RG P)-(3 RG O5') -160.0 20.0 &rst iat = 57, 63, 64, 67, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 3 URA ZETA: (3 RG C3')-(3 RG O3')-(4 RU P)-(4 RU O5') -160.0 20.0 &rst iat = 91, 97, 98, 101, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 4 CYT ZETA: (4 RU C3')-(4 RU O3')-(5 RA P)-(5 RA O5') -160.0 20.0 &rst iat = 121, 127, 128, 131, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 5 ADE ZETA: (5 RA C3')-(5 RA O3')-(6 RC P)-(6 RC O5') -160.0 20.0 &rst iat = 154, 160, 161, 164, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 6 CYT ZETA: (6 RC C3')-(6 RC O3')-(7 RG P)-(7 RG O5') -160.0 20.0 &rst iat = 185, 191, 192, 195, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 7 CYT ZETA: (7 RG C3')-(7 RG O3')-(8 RC3 P)-(8 RC3 O5') -160.0 20.0 &rst iat = 219, 225, 226, 229, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 8 URA ZETA: (9 RG5 C3')-(9 RG5 O3')-(10 RC P)-(10 RC O5') -160.0 20.0 &rst iat = 283, 289, 290, 293, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 10 CYT ZETA: (10 RC C3')-(10 RC O3')-(11 RG P)-(11 RG O5') -160.0 20.0 &rst iat = 314, 320, 321, 324, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 11 ADE ZETA: (11 RG C3')-(11 RG O3')-(12 RU P)-(12 RU O5') -160.0 20.0 &rst iat = 348, 354, 355, 358, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 12 GUA ZETA: (12 RU C3')-(12 RU O3')-(13 RA P)-(13 RA O5') -160.0 20.0 &rst iat = 378, 384, 385, 388, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 13 GUA ZETA: (13 RA C3')-(13 RA O3')-(14 RC P)-(14 RC O5') -160.0 20.0 &rst iat = 411, 417, 418, 421, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 14 URA ZETA: (14 RC C3')-(14 RC O3')-(15 RG P)-(15 RG O5') -160.0 20.0 &rst iat = 442, 448, 449, 452, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 15 GUA ZETA: (15 RG C3')-(15 RG O3')-(16 RC3 P)-(16 RC3 O5') -160.0 20.0 &rst iat = 476, 482, 483, 486, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 16 URA ZETA: (15 RG C3')-(15 RG O3')-(16 RC3 P)-(16 RC3 O5') -160.0 20.0 &rst iat = 476, 482, 483, 486, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 17 URA ZETA: (15 RG C3')-(15 RG O3')-(16 RC3 P)-(16 RC3 O5') -160.0 20.0 &rst iat = 476, 482, 483, 486, r1 = -161.0, r2 = -160.0, r3 = 20.0, r4 = 21.0, &end # 1 GUA CHI: (1 RG5 O4')-(1 RG5 C1')-(1 RG5 N9)-(1 RG5 C4) 170.0 340.0 &rst iat = 8, 9, 11, 25, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 2 ADE CHI: (2 RC O4')-(2 RC C1')-(2 RC N1)-(2 RC C2) 170.0 340.0 &rst iat = 42, 43, 45, 55, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 3 URA CHI: (3 RG O4')-(3 RG C1')-(3 RG N9)-(3 RG C4) 170.0 340.0 &rst iat = 73, 74, 76, 90, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 4 CYT CHI: (4 RU O4')-(4 RU C1')-(4 RU N1)-(4 RU C2) 170.0 340.0 &rst iat = 107, 108, 110, 119, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 5 ADE CHI: (5 RA O4')-(5 RA C1')-(5 RA N9)-(5 RA C4) 170.0 340.0 &rst iat = 137, 138, 140, 153, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 6 CYT CHI: (6 RC O4')-(6 RC C1')-(6 RC N1)-(6 RC C2) 170.0 340.0 &rst iat = 170, 171, 173, 183, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 7 CYT CHI: (7 RG O4')-(7 RG C1')-(7 RG N9)-(7 RG C4) 170.0 340.0 &rst iat = 201, 202, 204, 218, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 8 URA CHI: (8 RC3 O4')-(8 RC3 C1')-(8 RC3 N1)-(8 RC3 C2) 170.0 340.0 &rst iat = 235, 236, 238, 248, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 9 GUA CHI: (9 RG5 O4')-(9 RG5 C1')-(9 RG5 N9)-(9 RG5 C4) 170.0 340.0 &rst iat = 265, 266, 268, 282, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 10 CYT CHI: (10 RC O4')-(10 RC C1')-(10 RC N1)-(10 RC C2) 170.0 340.0 &rst iat = 299, 300, 302, 312, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 11 ADE CHI: (11 RG O4')-(11 RG C1')-(11 RG N9)-(11 RG C4) 170.0 340.0 &rst iat = 330, 331, 333, 347, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 12 GUA CHI: (12 RU O4')-(12 RU C1')-(12 RU N1)-(12 RU C2) 170.0 340.0 &rst iat = 364, 365, 367, 376, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 13 GUA CHI: (13 RA O4')-(13 RA C1')-(13 RA N9)-(13 RA C4) 170.0 340.0 &rst iat = 394, 395, 397, 410, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 14 URA CHI: (14 RC O4')-(14 RC C1')-(14 RC N1)-(14 RC C2) 170.0 340.0 &rst iat = 427, 428, 430, 440, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 15 GUA CHI: (15 RG O4')-(15 RG C1')-(15 RG N9)-(15 RG C4) 170.0 340.0 &rst iat = 458, 459, 461, 475, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 16 URA CHI: (16 RC3 O4')-(16 RC3 C1')-(16 RC3 N1)-(16 RC3 C2) 170.0 340.0 &rst iat = 492, 493, 495, 505, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 17 URA CHI: (16 RC3 O4')-(16 RC3 C1')-(16 RC3 N1)-(16 RC3 C2) 170.0 340.0 &rst iat = 492, 493, 495, 505, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end # 18 CYT CHI: (16 RC3 O4')-(16 RC3 C1')-(16 RC3 N1)-(16 RC3 C2) 170.0 340.0 &rst iat = 492, 493, 495, 505, r1 = 169.0, r2 = 170.0, r3 = 340.0, r4 = 341.0, &end