NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type subtype subsubtype
19893 2ew9 cing 1-original 1 AMBER distance NOE simple



# AMBER 5.0 input file

# Atom 1: H ALA 2, Atom 2: QB ALA 2
 &rst iat=23, -1, r3=3.600000, r4=4.100000, r1=1.500000, r2=2.000000,
 rk2=50.000000, rk3=50.000000, ir6=1, igr2=27, 28, 29, &end
# Atom 1: QB ALA 2, Atom 2: HNE1 GLN 4
 &rst iat=-1, 59, r3=4.200000, r4=4.700000, igr1=27, 28, 29, &end
# Atom 1: QB ALA 2, Atom 2: HNE2 GLN 4
 &rst iat=-1, 60, r3=4.200000, r4=4.700000, igr1=27, 28, 29, &end
# Atom 1: HA PRO 3, Atom 2: H GLN 4
 &rst iat=43, 47, r3=2.400000, r4=2.900000, &end
# Atom 1: HA PRO 3, Atom 2: H TYR 48
 &rst iat=43, 736, r3=5.900000, r4=6.400000, &end
# Atom 1: HB2 PRO 3, Atom 2: H GLN 4
 &rst iat=40, 47, r3=4.100000, r4=4.600000, &end
# Atom 1: HB3 PRO 3, Atom 2: H GLN 4
 &rst iat=41, 47, r3=4.100000, r4=4.600000, &end
# Atom 1: QB PRO 3, Atom 2: H GLN 4
 &rst iat=-1, 47, r3=3.850000, r4=4.350000, igr1=40, 41, &end
# Atom 1: HG2 PRO 3, Atom 2: HNE1 GLN 4
 &rst iat=37, 59, r3=7.750000, r4=8.250000, &end
# Atom 1: HG2 PRO 3, Atom 2: HNE2 GLN 4
 &rst iat=37, 60, r3=7.750000, r4=8.250000, &end
# Atom 1: HG3 PRO 3, Atom 2: HNE1 GLN 4
 &rst iat=38, 59, r3=7.750000, r4=8.250000, &end
# Atom 1: HG3 PRO 3, Atom 2: HNE2 GLN 4
 &rst iat=38, 60, r3=7.750000, r4=8.250000, &end
# Atom 1: QG PRO 3, Atom 2: H GLN 4
 &rst iat=-1, 47, r3=5.470000, r4=5.970000, igr1=37, 38, &end
# Atom 1: QG PRO 3, Atom 2: QNE GLN 4
 &rst iat=-1, -1, r3=6.770000, r4=7.270000, 
 igr1=37, 38, igr2=59, 60, &end
# Atom 1: H GLN 4, Atom 2: HB2 GLN 4
 &rst iat=47, 51, r3=4.000000, r4=4.500000, &end
# Atom 1: H GLN 4, Atom 2: HB3 GLN 4
 &rst iat=47, 52, r3=4.000000, r4=4.500000, &end
# Atom 1: H GLN 4, Atom 2: HG2 GLN 4
 &rst iat=47, 54, r3=5.100000, r4=5.600000, &end
# Atom 1: H GLN 4, Atom 2: HG3 GLN 4
 &rst iat=47, 55, r3=5.100000, r4=5.600000, &end
# Atom 1: H GLN 4, Atom 2: QG GLN 4
 &rst iat=47, -1, r3=4.730000, r4=5.230000, igr2=54, 55, &end
# Atom 1: H GLN 4, Atom 2: HNE1 GLN 4
 &rst iat=47, 59, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLN 4, Atom 2: HNE2 GLN 4
 &rst iat=47, 60, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLN 4, Atom 2: QNE GLN 4
 &rst iat=47, -1, r3=5.640000, r4=6.140000, igr2=59, 60, &end
# Atom 1: H GLN 4, Atom 2: H LYS 5
 &rst iat=47, 64, r3=4.500000, r4=5.000000, &end
# Atom 1: H GLN 4, Atom 2: QQD LEU 33
 &rst iat=47, -1, r3=8.270000, r4=8.770000, igr2=511, 512, 513, 515, 516, 517, &end
# Atom 1: H GLN 4, Atom 2: HA LYS 47
 &rst iat=47, 716, r3=5.800000, r4=6.300000, &end
# Atom 1: H GLN 4, Atom 2: HG2 LYS 47
 &rst iat=47, 721, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLN 4, Atom 2: HG3 LYS 47
 &rst iat=47, 722, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLN 4, Atom 2: H TYR 48
 &rst iat=47, 736, r3=5.000000, r4=5.500000, &end
# Atom 1: H GLN 4, Atom 2: QD TYR 48
 &rst iat=47, -1, r3=8.000000, r4=8.500000, igr2=744, 753, &end
# Atom 1: H GLN 4, Atom 2: QE TYR 48
 &rst iat=47, -1, r3=8.000000, r4=8.500000, igr2=746, 751, &end
# Atom 1: H GLN 4, Atom 2: H ASP 49
 &rst iat=47, 757, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLN 4, Atom 2: HA ASP 49
 &rst iat=47, 759, r3=5.700000, r4=6.200000, &end
# Atom 1: H GLN 4, Atom 2: QB ASP 49
 &rst iat=47, -1, r3=6.880000, r4=7.380000, igr2=761, 762, &end
# Atom 1: H GLN 4, Atom 2: HD2 PRO 50
 &rst iat=47, 770, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLN 4, Atom 2: HD3 PRO 50
 &rst iat=47, 771, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLN 4, Atom 2: QD PRO 50
 &rst iat=47, -1, r3=5.740000, r4=6.240000, igr2=770, 771, &end
# Atom 1: HA GLN 4, Atom 2: HNE1 GLN 4
 &rst iat=49, 59, r3=5.100000, r4=5.600000, &end
# Atom 1: HA GLN 4, Atom 2: HNE2 GLN 4
 &rst iat=49, 60, r3=5.100000, r4=5.600000, &end
# Atom 1: HA GLN 4, Atom 2: QNE GLN 4
 &rst iat=49, -1, r3=4.830000, r4=5.330000, igr2=59, 60, &end
# Atom 1: HA GLN 4, Atom 2: H LYS 5
 &rst iat=49, 64, r3=3.300000, r4=3.800000, &end
# Atom 1: HB2 GLN 4, Atom 2: HNE1 GLN 4
 &rst iat=51, 59, r3=5.400000, r4=5.900000, &end
# Atom 1: HB2 GLN 4, Atom 2: HNE2 GLN 4
 &rst iat=51, 60, r3=5.400000, r4=5.900000, &end
# Atom 1: HB2 GLN 4, Atom 2: H LYS 5
 &rst iat=51, 64, r3=4.300000, r4=4.800000, &end
# Atom 1: HB2 GLN 4, Atom 2: H TYR 48
 &rst iat=51, 736, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 GLN 4, Atom 2: HNE1 GLN 4
 &rst iat=52, 59, r3=5.400000, r4=5.900000, &end
# Atom 1: HB3 GLN 4, Atom 2: HNE2 GLN 4
 &rst iat=52, 60, r3=5.400000, r4=5.900000, &end
# Atom 1: HB3 GLN 4, Atom 2: H LYS 5
 &rst iat=52, 64, r3=4.300000, r4=4.800000, &end
# Atom 1: HB3 GLN 4, Atom 2: H TYR 48
 &rst iat=52, 736, r3=6.000000, r4=6.500000, &end
# Atom 1: QB GLN 4, Atom 2: H LYS 5
 &rst iat=-1, 64, r3=3.870000, r4=4.370000, igr1=51, 52, &end
# Atom 1: QB GLN 4, Atom 2: H TYR 48
 &rst iat=-1, 736, r3=5.790000, r4=6.290000, igr1=51, 52, &end
# Atom 1: HG2 GLN 4, Atom 2: H LYS 5
 &rst iat=54, 64, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLN 4, Atom 2: H LYS 5
 &rst iat=55, 64, r3=6.000000, r4=6.500000, &end
# Atom 1: QG GLN 4, Atom 2: H LYS 5
 &rst iat=-1, 64, r3=5.840000, r4=6.340000, igr1=54, 55, &end
# Atom 1: QG GLN 4, Atom 2: H TYR 48
 &rst iat=-1, 736, r3=6.880000, r4=7.380000, igr1=54, 55, &end
# Atom 1: HNE1 GLN 4, Atom 2: HD2 PRO 50
 &rst iat=59, 770, r3=7.630000, r4=8.130000, &end
# Atom 1: HNE1 GLN 4, Atom 2: HD3 PRO 50
 &rst iat=59, 771, r3=7.630000, r4=8.130000, &end
# Atom 1: HNE2 GLN 4, Atom 2: HD2 PRO 50
 &rst iat=60, 770, r3=7.630000, r4=8.130000, &end
# Atom 1: HNE2 GLN 4, Atom 2: HD3 PRO 50
 &rst iat=60, 771, r3=7.630000, r4=8.130000, &end
# Atom 1: QNE GLN 4, Atom 2: H LYS 5
 &rst iat=-1, 64, r3=6.870000, r4=7.370000, igr1=59, 60, &end
# Atom 1: QNE GLN 4, Atom 2: QD PRO 50
 &rst iat=-1, -1, r3=6.510000, r4=7.010000, 
 igr1=59, 60, igr2=770, 771, &end
# Atom 1: QNE GLN 4, Atom 2: H GLU 51
 &rst iat=-1, 783, r3=6.870000, r4=7.370000, igr1=59, 60, &end
# Atom 1: H LYS 5, Atom 2: HB2 LYS 5
 &rst iat=64, 68, r3=4.100000, r4=4.600000, &end
# Atom 1: H LYS 5, Atom 2: HB3 LYS 5
 &rst iat=64, 69, r3=4.100000, r4=4.600000, &end
# Atom 1: H LYS 5, Atom 2: HG2 LYS 5
 &rst iat=64, 71, r3=4.700000, r4=5.200000, &end
# Atom 1: H LYS 5, Atom 2: HG3 LYS 5
 &rst iat=64, 72, r3=4.700000, r4=5.200000, &end
# Atom 1: H LYS 5, Atom 2: QG LYS 5
 &rst iat=64, -1, r3=4.420000, r4=4.920000, igr2=71, 72, &end
# Atom 1: H LYS 5, Atom 2: QD LYS 5
 &rst iat=64, -1, r3=5.700000, r4=6.200000, igr2=74, 75, &end
# Atom 1: H LYS 5, Atom 2: QE LYS 5
 &rst iat=64, -1, r3=7.000000, r4=7.500000, igr2=77, 78, &end
# Atom 1: H LYS 5, Atom 2: H CYS 6
 &rst iat=64, 86, r3=4.700000, r4=5.200000, &end
# Atom 1: H LYS 5, Atom 2: QE LYS 47
 &rst iat=64, -1, r3=7.000000, r4=7.500000, igr2=727, 728, &end
# Atom 1: H LYS 5, Atom 2: H TYR 48
 &rst iat=64, 736, r3=5.400000, r4=5.900000, &end
# Atom 1: H LYS 5, Atom 2: QD TYR 48
 &rst iat=64, -1, r3=8.000000, r4=8.500000, igr2=744, 753, &end
# Atom 1: H LYS 5, Atom 2: QE TYR 48
 &rst iat=64, -1, r3=8.000000, r4=8.500000, igr2=746, 751, &end
# Atom 1: HA LYS 5, Atom 2: H CYS 6
 &rst iat=66, 86, r3=3.200000, r4=3.700000, &end
# Atom 1: HB2 LYS 5, Atom 2: H CYS 6
 &rst iat=68, 86, r3=4.100000, r4=4.600000, &end
# Atom 1: HB3 LYS 5, Atom 2: H CYS 6
 &rst iat=69, 86, r3=4.100000, r4=4.600000, &end
# Atom 1: QB LYS 5, Atom 2: H CYS 6
 &rst iat=-1, 86, r3=3.850000, r4=4.350000, igr1=68, 69, &end
# Atom 1: HG2 LYS 5, Atom 2: H CYS 6
 &rst iat=71, 86, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 LYS 5, Atom 2: H CYS 6
 &rst iat=72, 86, r3=6.000000, r4=6.500000, &end
# Atom 1: QG LYS 5, Atom 2: H CYS 6
 &rst iat=-1, 86, r3=5.590000, r4=6.090000, igr1=71, 72, &end
# Atom 1: QG LYS 5, Atom 2: H TYR 48
 &rst iat=-1, 736, r3=6.880000, r4=7.380000, igr1=71, 72, &end
# Atom 1: H CYS 6, Atom 2: H PHE 7
 &rst iat=86, 99, r3=4.400000, r4=4.900000, &end
# Atom 1: H CYS 6, Atom 2: QD PHE 7
 &rst iat=86, -1, r3=8.000000, r4=8.500000, igr2=107, 115, &end
# Atom 1: H CYS 6, Atom 2: HA GLU 45
 &rst iat=86, 682, r3=6.000000, r4=6.500000, &end
# Atom 1: H CYS 6, Atom 2: H ILE 46
 &rst iat=86, 695, r3=5.100000, r4=5.600000, &end
# Atom 1: H CYS 6, Atom 2: QG2 ILE 46
 &rst iat=86, -1, r3=7.000000, r4=7.500000, igr2=701, 702, 703, &end
# Atom 1: H CYS 6, Atom 2: QD ILE 46
 &rst iat=86, -1, r3=7.000000, r4=7.500000, igr2=708, 709, 710, &end
# Atom 1: H CYS 6, Atom 2: QE LYS 47
 &rst iat=86, -1, r3=7.000000, r4=7.500000, igr2=727, 728, &end
# Atom 1: H CYS 6, Atom 2: QD TYR 48
 &rst iat=86, -1, r3=8.000000, r4=8.500000, igr2=744, 753, &end
# Atom 1: H CYS 6, Atom 2: QE TYR 48
 &rst iat=86, -1, r3=8.000000, r4=8.500000, igr2=746, 751, &end
# Atom 1: HA CYS 6, Atom 2: H PHE 7
 &rst iat=88, 99, r3=3.400000, r4=3.900000, &end
# Atom 1: HA CYS 6, Atom 2: HA PHE 7
 &rst iat=88, 101, r3=4.700000, r4=5.200000, &end
# Atom 1: HA CYS 6, Atom 2: H ILE 46
 &rst iat=88, 695, r3=6.000000, r4=6.500000, &end
# Atom 1: QB CYS 6, Atom 2: H PHE 7
 &rst iat=-1, 99, r3=4.100000, r4=4.600000, igr1=90, 91, &end
# Atom 1: QB CYS 6, Atom 2: H ILE 46
 &rst iat=-1, 695, r3=7.000000, r4=7.500000, igr1=90, 91, &end
# Atom 1: QB CYS 6, Atom 2: H TYR 48
 &rst iat=-1, 736, r3=7.000000, r4=7.500000, igr1=90, 91, &end
# Atom 1: H PHE 7, Atom 2: QE PHE 7
 &rst iat=99, -1, r3=6.600000, r4=7.100000, igr2=109, 113, &end
# Atom 1: H PHE 7, Atom 2: H LEU 8
 &rst iat=99, 119, r3=4.900000, r4=5.400000, &end
# Atom 1: H PHE 7, Atom 2: QG1 VAL 71
 &rst iat=99, -1, r3=7.000000, r4=7.500000, igr2=1099, 1100, 1101, &end
# Atom 1: H PHE 7, Atom 2: QG2 VAL 71
 &rst iat=99, -1, r3=7.000000, r4=7.500000, igr2=1103, 1104, 1105, &end
# Atom 1: H PHE 7, Atom 2: QQG VAL 71
 &rst iat=99, -1, r3=6.470000, r4=6.970000, igr2=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: H PHE 7, Atom 2: H MET 72
 &rst iat=99, 1109, r3=5.500000, r4=6.000000, &end
# Atom 1: H PHE 7, Atom 2: QB MET 72
 &rst iat=99, -1, r3=6.880000, r4=7.380000, igr2=1113, 1114, &end
# Atom 1: H PHE 7, Atom 2: QG MET 72
 &rst iat=99, -1, r3=7.000000, r4=7.500000, igr2=1116, 1117, &end
# Atom 1: H PHE 7, Atom 2: QD TYR 75
 &rst iat=99, -1, r3=8.000000, r4=8.500000, igr2=1163, 1172, &end
# Atom 1: HA PHE 7, Atom 2: H LEU 8
 &rst iat=101, 119, r3=3.500000, r4=4.000000, &end
# Atom 1: HA PHE 7, Atom 2: HA LEU 8
 &rst iat=101, 121, r3=5.100000, r4=5.600000, &end
# Atom 1: HA PHE 7, Atom 2: HB2 LEU 8
 &rst iat=101, 123, r3=6.000000, r4=6.500000, &end
# Atom 1: HA PHE 7, Atom 2: HB3 LEU 8
 &rst iat=101, 124, r3=6.000000, r4=6.500000, &end
# Atom 1: HA PHE 7, Atom 2: QB LEU 8
 &rst iat=101, -1, r3=5.840000, r4=6.340000, igr2=123, 124, &end
# Atom 1: HA PHE 7, Atom 2: QQD LEU 8
 &rst iat=101, -1, r3=8.570000, r4=9.070000, igr2=128, 129, 130, 132, 133, 134, &end
# Atom 1: HA PHE 7, Atom 2: H ALA 44
 &rst iat=101, 670, r3=6.000000, r4=6.500000, &end
# Atom 1: HA PHE 7, Atom 2: H GLU 45
 &rst iat=101, 680, r3=6.000000, r4=6.500000, &end
# Atom 1: HA PHE 7, Atom 2: HA GLU 45
 &rst iat=101, 682, r3=4.600000, r4=5.100000, &end
# Atom 1: HA PHE 7, Atom 2: H ILE 46
 &rst iat=101, 695, r3=5.200000, r4=5.700000, &end
# Atom 1: HA PHE 7, Atom 2: H MET 72
 &rst iat=101, 1109, r3=6.000000, r4=6.500000, &end
# Atom 1: HA PHE 7, Atom 2: QG MET 72
 &rst iat=101, -1, r3=7.000000, r4=7.500000, igr2=1116, 1117, &end
# Atom 1: HB2 PHE 7, Atom 2: H LEU 8
 &rst iat=103, 119, r3=4.700000, r4=5.200000, &end
# Atom 1: HB2 PHE 7, Atom 2: H MET 72
 &rst iat=103, 1109, r3=5.500000, r4=6.000000, &end
# Atom 1: HB2 PHE 7, Atom 2: HB2 MET 72
 &rst iat=103, 1113, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 PHE 7, Atom 2: HB3 MET 72
 &rst iat=103, 1114, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 PHE 7, Atom 2: QG MET 72
 &rst iat=103, -1, r3=7.000000, r4=7.500000, igr2=1116, 1117, &end
# Atom 1: HB2 PHE 7, Atom 2: H GLU 73
 &rst iat=103, 1128, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 PHE 7, Atom 2: H LEU 8
 &rst iat=104, 119, r3=4.700000, r4=5.200000, &end
# Atom 1: HB3 PHE 7, Atom 2: H MET 72
 &rst iat=104, 1109, r3=5.500000, r4=6.000000, &end
# Atom 1: HB3 PHE 7, Atom 2: HB2 MET 72
 &rst iat=104, 1113, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 PHE 7, Atom 2: HB3 MET 72
 &rst iat=104, 1114, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 PHE 7, Atom 2: QG MET 72
 &rst iat=104, -1, r3=7.000000, r4=7.500000, igr2=1116, 1117, &end
# Atom 1: HB3 PHE 7, Atom 2: H GLU 73
 &rst iat=104, 1128, r3=6.000000, r4=6.500000, &end
# Atom 1: QB PHE 7, Atom 2: H LEU 8
 &rst iat=-1, 119, r3=4.370000, r4=4.870000, igr1=103, 104, &end
# Atom 1: QB PHE 7, Atom 2: H GLU 73
 &rst iat=-1, 1128, r3=5.790000, r4=6.290000, igr1=103, 104, &end
# Atom 1: QB PHE 7, Atom 2: HA ASP 74
 &rst iat=-1, 1145, r3=6.880000, r4=7.380000, igr1=103, 104, &end
# Atom 1: QD PHE 7, Atom 2: H LEU 8
 &rst iat=-1, 119, r3=8.000000, r4=8.500000, igr1=107, 115, &end
# Atom 1: QD PHE 7, Atom 2: H ALA 44
 &rst iat=-1, 670, r3=8.000000, r4=8.500000, igr1=107, 115, &end
# Atom 1: QD PHE 7, Atom 2: H GLU 45
 &rst iat=-1, 680, r3=8.000000, r4=8.500000, igr1=107, 115, &end
# Atom 1: QD PHE 7, Atom 2: H ILE 46
 &rst iat=-1, 695, r3=8.000000, r4=8.500000, igr1=107, 115, &end
# Atom 1: QD PHE 7, Atom 2: QB MET 72
 &rst iat=-1, -1, r3=8.880000, r4=9.380000, 
 igr1=107, 115, igr2=1113, 1114, &end
# Atom 1: QD PHE 7, Atom 2: HA ASP 74
 &rst iat=-1, 1145, r3=8.000000, r4=8.500000, igr1=107, 115, &end
# Atom 1: QE PHE 7, Atom 2: H GLU 45
 &rst iat=-1, 680, r3=8.000000, r4=8.500000, igr1=109, 113, &end
# Atom 1: QE PHE 7, Atom 2: H ILE 46
 &rst iat=-1, 695, r3=8.000000, r4=8.500000, igr1=109, 113, &end
# Atom 1: QE PHE 7, Atom 2: QB MET 72
 &rst iat=-1, -1, r3=8.880000, r4=9.380000, 
 igr1=109, 113, igr2=1113, 1114, &end
# Atom 1: H LEU 8, Atom 2: HG LEU 8
 &rst iat=119, 126, r3=4.400000, r4=4.900000, &end
# Atom 1: H LEU 8, Atom 2: QQD LEU 8
 &rst iat=119, -1, r3=4.970000, r4=5.470000, igr2=128, 129, 130, 132, 133, 134, &end
# Atom 1: H LEU 8, Atom 2: H GLN 9
 &rst iat=119, 138, r3=5.200000, r4=5.700000, &end
# Atom 1: H LEU 8, Atom 2: QB GLN 9
 &rst iat=119, -1, r3=7.000000, r4=7.500000, igr2=142, 143, &end
# Atom 1: H LEU 8, Atom 2: H ALA 44
 &rst iat=119, 670, r3=5.100000, r4=5.600000, &end
# Atom 1: H LEU 8, Atom 2: QB ALA 44
 &rst iat=119, -1, r3=4.800000, r4=5.300000, igr2=674, 675, 676, &end
# Atom 1: H LEU 8, Atom 2: HA GLU 45
 &rst iat=119, 682, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 8, Atom 2: QB GLU 45
 &rst iat=119, -1, r3=7.000000, r4=7.500000, igr2=684, 685, &end
# Atom 1: HA LEU 8, Atom 2: H GLN 9
 &rst iat=121, 138, r3=3.300000, r4=3.800000, &end
# Atom 1: HA LEU 8, Atom 2: H ALA 70
 &rst iat=121, 1083, r3=5.500000, r4=6.000000, &end
# Atom 1: HA LEU 8, Atom 2: H VAL 71
 &rst iat=121, 1093, r3=6.000000, r4=6.500000, &end
# Atom 1: HA LEU 8, Atom 2: HA VAL 71
 &rst iat=121, 1095, r3=4.300000, r4=4.800000, &end
# Atom 1: HA LEU 8, Atom 2: HB VAL 71
 &rst iat=121, 1097, r3=6.000000, r4=6.500000, &end
# Atom 1: HA LEU 8, Atom 2: QG1 VAL 71
 &rst iat=121, -1, r3=7.000000, r4=7.500000, igr2=1099, 1100, 1101, &end
# Atom 1: HA LEU 8, Atom 2: QG2 VAL 71
 &rst iat=121, -1, r3=7.000000, r4=7.500000, igr2=1103, 1104, 1105, &end
# Atom 1: HA LEU 8, Atom 2: QQG VAL 71
 &rst iat=121, -1, r3=6.430000, r4=6.930000, igr2=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: HA LEU 8, Atom 2: H MET 72
 &rst iat=121, 1109, r3=4.900000, r4=5.400000, &end
# Atom 1: HA LEU 8, Atom 2: QB MET 72
 &rst iat=121, -1, r3=6.880000, r4=7.380000, igr2=1113, 1114, &end
# Atom 1: HA LEU 8, Atom 2: QG MET 72
 &rst iat=121, -1, r3=7.000000, r4=7.500000, igr2=1116, 1117, &end
# Atom 1: HB2 LEU 8, Atom 2: H GLN 9
 &rst iat=123, 138, r3=3.900000, r4=4.400000, &end
# Atom 1: HB2 LEU 8, Atom 2: HA GLN 9
 &rst iat=123, 140, r3=5.800000, r4=6.300000, &end
# Atom 1: HB2 LEU 8, Atom 2: QB ALA 44
 &rst iat=123, -1, r3=6.600000, r4=7.100000, igr2=674, 675, 676, &end
# Atom 1: HB2 LEU 8, Atom 2: H ALA 70
 &rst iat=123, 1083, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 LEU 8, Atom 2: HA VAL 71
 &rst iat=123, 1095, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 LEU 8, Atom 2: HB VAL 71
 &rst iat=123, 1097, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 LEU 8, Atom 2: QG1 VAL 71
 &rst iat=123, -1, r3=8.750000, r4=9.250000, igr2=1099, 1100, 1101, &end
# Atom 1: HB2 LEU 8, Atom 2: QG2 VAL 71
 &rst iat=123, -1, r3=8.750000, r4=9.250000, igr2=1103, 1104, 1105, &end
# Atom 1: HB2 LEU 8, Atom 2: H MET 72
 &rst iat=123, 1109, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 LEU 8, Atom 2: H GLN 9
 &rst iat=124, 138, r3=3.900000, r4=4.400000, &end
# Atom 1: HB3 LEU 8, Atom 2: HA GLN 9
 &rst iat=124, 140, r3=5.800000, r4=6.300000, &end
# Atom 1: HB3 LEU 8, Atom 2: QB ALA 44
 &rst iat=124, -1, r3=6.600000, r4=7.100000, igr2=674, 675, 676, &end
# Atom 1: HB3 LEU 8, Atom 2: H ALA 70
 &rst iat=124, 1083, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 LEU 8, Atom 2: HA VAL 71
 &rst iat=124, 1095, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 LEU 8, Atom 2: HB VAL 71
 &rst iat=124, 1097, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 LEU 8, Atom 2: QG1 VAL 71
 &rst iat=124, -1, r3=8.750000, r4=9.250000, igr2=1099, 1100, 1101, &end
# Atom 1: HB3 LEU 8, Atom 2: QG2 VAL 71
 &rst iat=124, -1, r3=8.750000, r4=9.250000, igr2=1103, 1104, 1105, &end
# Atom 1: HB3 LEU 8, Atom 2: H MET 72
 &rst iat=124, 1109, r3=6.000000, r4=6.500000, &end
# Atom 1: QB LEU 8, Atom 2: QB ALA 44
 &rst iat=-1, -1, r3=6.290000, r4=6.790000, 
 igr1=123, 124, igr2=674, 675, 676, &end
# Atom 1: QB LEU 8, Atom 2: QQG VAL 71
 &rst iat=-1, -1, r3=6.810000, r4=7.310000, 
 igr1=123, 124, igr2=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: QB LEU 8, Atom 2: HA MET 72
 &rst iat=-1, 1111, r3=6.880000, r4=7.380000, igr1=123, 124, &end
# Atom 1: QB LEU 8, Atom 2: QG MET 72
 &rst iat=-1, -1, r3=7.880000, r4=8.380000, 
 igr1=123, 124, igr2=1116, 1117, &end
# Atom 1: QB LEU 8, Atom 2: H GLU 73
 &rst iat=-1, 1128, r3=6.880000, r4=7.380000, igr1=123, 124, &end
# Atom 1: HG LEU 8, Atom 2: H GLN 9
 &rst iat=126, 138, r3=6.000000, r4=6.500000, &end
# Atom 1: HG LEU 8, Atom 2: H ILE 46
 &rst iat=126, 695, r3=6.000000, r4=6.500000, &end
# Atom 1: HG LEU 8, Atom 2: H ALA 70
 &rst iat=126, 1083, r3=6.000000, r4=6.500000, &end
# Atom 1: HG LEU 8, Atom 2: H VAL 71
 &rst iat=126, 1093, r3=6.000000, r4=6.500000, &end
# Atom 1: HG LEU 8, Atom 2: HA VAL 71
 &rst iat=126, 1095, r3=6.000000, r4=6.500000, &end
# Atom 1: HG LEU 8, Atom 2: H MET 72
 &rst iat=126, 1109, r3=6.000000, r4=6.500000, &end
# Atom 1: QD1 LEU 8, Atom 2: QD ILE 58
 &rst iat=-1, -1, r3=7.300000, r4=7.800000, 
 igr1=128, 129, 130, igr2=911, 912, 913, &end
# Atom 1: QD1 LEU 8, Atom 2: HA VAL 71
 &rst iat=-1, 1095, r3=5.700000, r4=6.200000, igr1=128, 129, 130, &end
# Atom 1: QD2 LEU 8, Atom 2: QD ILE 58
 &rst iat=-1, -1, r3=7.300000, r4=7.800000, 
 igr1=132, 133, 134, igr2=911, 912, 913, &end
# Atom 1: QD2 LEU 8, Atom 2: HA VAL 71
 &rst iat=-1, 1095, r3=5.700000, r4=6.200000, igr1=132, 133, 134, &end
# Atom 1: QQD LEU 8, Atom 2: H GLN 9
 &rst iat=-1, 138, r3=8.570000, r4=9.070000, igr1=128, 129, 130, 132, 133, 134, &end
# Atom 1: QQD LEU 8, Atom 2: QB ALA 69
 &rst iat=-1, -1, r3=6.570000, r4=7.070000, 
 igr1=128, 129, 130, 132, 133, 134, igr2=1077, 1078, 1079, &end
# Atom 1: QQD LEU 8, Atom 2: H VAL 71
 &rst iat=-1, 1093, r3=8.070000, r4=8.570000, igr1=128, 129, 130, 132, 133, 134, &end
# Atom 1: QQD LEU 8, Atom 2: HA VAL 71
 &rst iat=-1, 1095, r3=5.180000, r4=5.680000, igr1=128, 129, 130, 132, 133, 134, &end
# Atom 1: QQD LEU 8, Atom 2: HB VAL 71
 &rst iat=-1, 1097, r3=6.270000, r4=6.770000, igr1=128, 129, 130, 132, 133, 134, &end
# Atom 1: QQD LEU 8, Atom 2: H MET 72
 &rst iat=-1, 1109, r3=7.770000, r4=8.270000, igr1=128, 129, 130, 132, 133, 134, &end
# Atom 1: QQD LEU 8, Atom 2: QG MET 72
 &rst iat=-1, -1, r3=9.570000, r4=10.070000, 
 igr1=128, 129, 130, 132, 133, 134, igr2=1116, 1117, &end
# Atom 1: H GLN 9, Atom 2: HG2 GLN 9
 &rst iat=138, 145, r3=4.100000, r4=4.600000, &end
# Atom 1: H GLN 9, Atom 2: HG3 GLN 9
 &rst iat=138, 146, r3=4.100000, r4=4.600000, &end
# Atom 1: H GLN 9, Atom 2: QG GLN 9
 &rst iat=138, -1, r3=3.900000, r4=4.400000, igr2=145, 146, &end
# Atom 1: H GLN 9, Atom 2: H ILE 10
 &rst iat=138, 155, r3=4.700000, r4=5.200000, &end
# Atom 1: H GLN 9, Atom 2: H ALA 70
 &rst iat=138, 1083, r3=4.700000, r4=5.200000, &end
# Atom 1: H GLN 9, Atom 2: HA ALA 70
 &rst iat=138, 1085, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLN 9, Atom 2: QB ALA 70
 &rst iat=138, -1, r3=6.200000, r4=6.700000, igr2=1087, 1088, 1089, &end
# Atom 1: H GLN 9, Atom 2: HA VAL 71
 &rst iat=138, 1095, r3=3.600000, r4=4.100000, &end
# Atom 1: H GLN 9, Atom 2: HB VAL 71
 &rst iat=138, 1097, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLN 9, Atom 2: QQG VAL 71
 &rst iat=138, -1, r3=7.660000, r4=8.160000, igr2=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: H GLN 9, Atom 2: H MET 72
 &rst iat=138, 1109, r3=4.700000, r4=5.200000, &end
# Atom 1: HA GLN 9, Atom 2: H LYS 43
 &rst iat=140, 648, r3=5.700000, r4=6.200000, &end
# Atom 1: HA GLN 9, Atom 2: HA LYS 43
 &rst iat=140, 650, r3=4.600000, r4=5.100000, &end
# Atom 1: HA GLN 9, Atom 2: H ALA 44
 &rst iat=140, 670, r3=5.400000, r4=5.900000, &end
# Atom 1: HA GLN 9, Atom 2: H ALA 70
 &rst iat=140, 1083, r3=5.900000, r4=6.400000, &end
# Atom 1: QB GLN 9, Atom 2: HNE1 GLN 9
 &rst iat=-1, 150, r3=6.600000, r4=7.100000, igr1=142, 143, &end
# Atom 1: QB GLN 9, Atom 2: HNE2 GLN 9
 &rst iat=-1, 151, r3=6.600000, r4=7.100000, igr1=142, 143, &end
# Atom 1: QB GLN 9, Atom 2: H ALA 44
 &rst iat=-1, 670, r3=7.000000, r4=7.500000, igr1=142, 143, &end
# Atom 1: QB GLN 9, Atom 2: HA ALA 69
 &rst iat=-1, 1075, r3=7.000000, r4=7.500000, igr1=142, 143, &end
# Atom 1: QB GLN 9, Atom 2: H ALA 70
 &rst iat=-1, 1083, r3=7.000000, r4=7.500000, igr1=142, 143, &end
# Atom 1: QB GLN 9, Atom 2: QB ALA 70
 &rst iat=-1, -1, r3=6.500000, r4=7.000000, 
 igr1=142, 143, igr2=1087, 1088, 1089, &end
# Atom 1: HG2 GLN 9, Atom 2: H ILE 10
 &rst iat=145, 155, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 GLN 9, Atom 2: H ALA 44
 &rst iat=145, 670, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 GLN 9, Atom 2: QB ALA 70
 &rst iat=145, -1, r3=6.100000, r4=6.600000, igr2=1087, 1088, 1089, &end
# Atom 1: HG3 GLN 9, Atom 2: H ILE 10
 &rst iat=146, 155, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLN 9, Atom 2: H ALA 44
 &rst iat=146, 670, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLN 9, Atom 2: QB ALA 70
 &rst iat=146, -1, r3=6.100000, r4=6.600000, igr2=1087, 1088, 1089, &end
# Atom 1: QG GLN 9, Atom 2: H ALA 70
 &rst iat=-1, 1083, r3=6.880000, r4=7.380000, igr1=145, 146, &end
# Atom 1: QG GLN 9, Atom 2: QB ALA 70
 &rst iat=-1, -1, r3=5.510000, r4=6.010000, 
 igr1=145, 146, igr2=1087, 1088, 1089, &end
# Atom 1: HNE1 GLN 9, Atom 2: HB2 LYS 11
 &rst iat=150, 178, r3=6.550000, r4=7.050000, &end
# Atom 1: HNE1 GLN 9, Atom 2: HB3 LYS 11
 &rst iat=150, 179, r3=6.550000, r4=7.050000, &end
# Atom 1: HNE1 GLN 9, Atom 2: HG2 LYS 11
 &rst iat=150, 181, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE1 GLN 9, Atom 2: HG3 LYS 11
 &rst iat=150, 182, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE1 GLN 9, Atom 2: QD LYS 11
 &rst iat=150, -1, r3=7.000000, r4=7.500000, igr2=184, 185, &end
# Atom 1: HNE1 GLN 9, Atom 2: QE LYS 11
 &rst iat=150, -1, r3=6.700000, r4=7.200000, igr2=187, 188, &end
# Atom 1: HNE1 GLN 9, Atom 2: HA VAL 71
 &rst iat=150, 1095, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE2 GLN 9, Atom 2: HB2 LYS 11
 &rst iat=151, 178, r3=6.550000, r4=7.050000, &end
# Atom 1: HNE2 GLN 9, Atom 2: HB3 LYS 11
 &rst iat=151, 179, r3=6.550000, r4=7.050000, &end
# Atom 1: HNE2 GLN 9, Atom 2: HG2 LYS 11
 &rst iat=151, 181, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE2 GLN 9, Atom 2: HG3 LYS 11
 &rst iat=151, 182, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE2 GLN 9, Atom 2: QD LYS 11
 &rst iat=151, -1, r3=7.000000, r4=7.500000, igr2=184, 185, &end
# Atom 1: HNE2 GLN 9, Atom 2: QE LYS 11
 &rst iat=151, -1, r3=6.700000, r4=7.200000, igr2=187, 188, &end
# Atom 1: HNE2 GLN 9, Atom 2: HA VAL 71
 &rst iat=151, 1095, r3=6.000000, r4=6.500000, &end
# Atom 1: QNE GLN 9, Atom 2: QB LYS 11
 &rst iat=-1, -1, r3=5.610000, r4=6.110000, 
 igr1=150, 151, igr2=178, 179, &end
# Atom 1: QNE GLN 9, Atom 2: QG LYS 11
 &rst iat=-1, -1, r3=5.050000, r4=5.550000, 
 igr1=150, 151, igr2=181, 182, &end
# Atom 1: QNE GLN 9, Atom 2: QE LYS 11
 &rst iat=-1, -1, r3=6.450000, r4=6.950000, 
 igr1=150, 151, igr2=187, 188, &end
# Atom 1: H ILE 10, Atom 2: HB ILE 10
 &rst iat=155, 159, r3=3.700000, r4=4.200000, &end
# Atom 1: H ILE 10, Atom 2: QG2 ILE 10
 &rst iat=155, -1, r3=4.400000, r4=4.900000, igr2=161, 162, 163, &end
# Atom 1: H ILE 10, Atom 2: HG12 ILE 10
 &rst iat=155, 165, r3=4.500000, r4=5.000000, &end
# Atom 1: H ILE 10, Atom 2: HG13 ILE 10
 &rst iat=155, 166, r3=4.500000, r4=5.000000, &end
# Atom 1: H ILE 10, Atom 2: QG1 ILE 10
 &rst iat=155, -1, r3=4.260000, r4=4.760000, igr2=165, 166, &end
# Atom 1: H ILE 10, Atom 2: QD ILE 10
 &rst iat=155, -1, r3=4.100000, r4=4.600000, igr2=168, 169, 170, &end
# Atom 1: H ILE 10, Atom 2: QE MET 13
 &rst iat=155, -1, r3=6.000000, r4=6.500000, igr2=216, 217, 218, &end
# Atom 1: H ILE 10, Atom 2: HA2 GLY 42
 &rst iat=155, 643, r3=5.800000, r4=6.300000, &end
# Atom 1: H ILE 10, Atom 2: HA3 GLY 42
 &rst iat=155, 644, r3=5.800000, r4=6.300000, &end
# Atom 1: H ILE 10, Atom 2: H LYS 43
 &rst iat=155, 648, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 10, Atom 2: HA LYS 43
 &rst iat=155, 650, r3=5.100000, r4=5.600000, &end
# Atom 1: H ILE 10, Atom 2: H ALA 44
 &rst iat=155, 670, r3=5.800000, r4=6.300000, &end
# Atom 1: H ILE 10, Atom 2: QB ALA 44
 &rst iat=155, -1, r3=6.800000, r4=7.300000, igr2=674, 675, 676, &end
# Atom 1: HA ILE 10, Atom 2: H LYS 11
 &rst iat=157, 174, r3=3.400000, r4=3.900000, &end
# Atom 1: HA ILE 10, Atom 2: H ALA 44
 &rst iat=157, 670, r3=5.900000, r4=6.400000, &end
# Atom 1: HA ILE 10, Atom 2: H GLU 68
 &rst iat=157, 1058, r3=5.800000, r4=6.300000, &end
# Atom 1: HA ILE 10, Atom 2: H ALA 69
 &rst iat=157, 1073, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ILE 10, Atom 2: HA ALA 69
 &rst iat=157, 1075, r3=4.500000, r4=5.000000, &end
# Atom 1: HA ILE 10, Atom 2: QB ALA 69
 &rst iat=157, -1, r3=6.300000, r4=6.800000, igr2=1077, 1078, 1079, &end
# Atom 1: HA ILE 10, Atom 2: H ALA 70
 &rst iat=157, 1083, r3=5.200000, r4=5.700000, &end
# Atom 1: HB ILE 10, Atom 2: H LYS 11
 &rst iat=159, 174, r3=4.400000, r4=4.900000, &end
# Atom 1: QG2 ILE 10, Atom 2: H LYS 11
 &rst iat=-1, 174, r3=6.300000, r4=6.800000, igr1=161, 162, 163, &end
# Atom 1: QG2 ILE 10, Atom 2: H GLY 12
 &rst iat=-1, 196, r3=7.000000, r4=7.500000, igr1=161, 162, 163, &end
# Atom 1: QG2 ILE 10, Atom 2: H MET 13
 &rst iat=-1, 203, r3=6.300000, r4=6.800000, igr1=161, 162, 163, &end
# Atom 1: QG2 ILE 10, Atom 2: H ALA 70
 &rst iat=-1, 1083, r3=7.000000, r4=7.500000, igr1=161, 162, 163, &end
# Atom 1: HG12 ILE 10, Atom 2: H ALA 44
 &rst iat=165, 670, r3=5.900000, r4=6.400000, &end
# Atom 1: HG13 ILE 10, Atom 2: H ALA 44
 &rst iat=166, 670, r3=5.900000, r4=6.400000, &end
# Atom 1: QG1 ILE 10, Atom 2: H ALA 44
 &rst iat=-1, 670, r3=5.730000, r4=6.230000, igr1=165, 166, &end
# Atom 1: QD ILE 10, Atom 2: H LYS 11
 &rst iat=-1, 174, r3=5.200000, r4=5.700000, igr1=168, 169, 170, &end
# Atom 1: QD ILE 10, Atom 2: H ALA 44
 &rst iat=-1, 670, r3=5.900000, r4=6.400000, igr1=168, 169, 170, &end
# Atom 1: QD ILE 10, Atom 2: H GLU 68
 &rst iat=-1, 1058, r3=5.900000, r4=6.400000, igr1=168, 169, 170, &end
# Atom 1: QD ILE 10, Atom 2: H ALA 69
 &rst iat=-1, 1073, r3=7.000000, r4=7.500000, igr1=168, 169, 170, &end
# Atom 1: QD ILE 10, Atom 2: HA ALA 69
 &rst iat=-1, 1075, r3=4.800000, r4=5.300000, igr1=168, 169, 170, &end
# Atom 1: QD ILE 10, Atom 2: QB ALA 69
 &rst iat=-1, -1, r3=4.900000, r4=5.400000, 
 igr1=168, 169, 170, igr2=1077, 1078, 1079, &end
# Atom 1: QD ILE 10, Atom 2: H ALA 70
 &rst iat=-1, 1083, r3=6.200000, r4=6.700000, igr1=168, 169, 170, &end
# Atom 1: H LYS 11, Atom 2: HB2 LYS 11
 &rst iat=174, 178, r3=4.100000, r4=4.600000, &end
# Atom 1: H LYS 11, Atom 2: HB3 LYS 11
 &rst iat=174, 179, r3=4.100000, r4=4.600000, &end
# Atom 1: H LYS 11, Atom 2: QB LYS 11
 &rst iat=174, -1, r3=3.900000, r4=4.400000, igr2=178, 179, &end
# Atom 1: H LYS 11, Atom 2: HG2 LYS 11
 &rst iat=174, 181, r3=4.400000, r4=4.900000, &end
# Atom 1: H LYS 11, Atom 2: HG3 LYS 11
 &rst iat=174, 182, r3=4.400000, r4=4.900000, &end
# Atom 1: H LYS 11, Atom 2: QD LYS 11
 &rst iat=174, -1, r3=6.700000, r4=7.200000, igr2=184, 185, &end
# Atom 1: H LYS 11, Atom 2: QE LYS 11
 &rst iat=174, -1, r3=7.000000, r4=7.500000, igr2=187, 188, &end
# Atom 1: H LYS 11, Atom 2: H GLY 12
 &rst iat=174, 196, r3=5.500000, r4=6.000000, &end
# Atom 1: H LYS 11, Atom 2: HB2 PHE 67
 &rst iat=174, 1042, r3=6.000000, r4=6.500000, &end
# Atom 1: H LYS 11, Atom 2: HB3 PHE 67
 &rst iat=174, 1043, r3=6.000000, r4=6.500000, &end
# Atom 1: H LYS 11, Atom 2: QD PHE 67
 &rst iat=174, -1, r3=8.000000, r4=8.500000, igr2=1046, 1054, &end
# Atom 1: H LYS 11, Atom 2: H GLU 68
 &rst iat=174, 1058, r3=5.000000, r4=5.500000, &end
# Atom 1: H LYS 11, Atom 2: HA GLU 68
 &rst iat=174, 1060, r3=6.000000, r4=6.500000, &end
# Atom 1: H LYS 11, Atom 2: QG GLU 68
 &rst iat=174, -1, r3=6.880000, r4=7.380000, igr2=1065, 1066, &end
# Atom 1: H LYS 11, Atom 2: H ALA 69
 &rst iat=174, 1073, r3=6.000000, r4=6.500000, &end
# Atom 1: H LYS 11, Atom 2: HA ALA 69
 &rst iat=174, 1075, r3=5.400000, r4=5.900000, &end
# Atom 1: H LYS 11, Atom 2: H ALA 70
 &rst iat=174, 1083, r3=5.400000, r4=5.900000, &end
# Atom 1: HB2 LYS 11, Atom 2: H GLY 12
 &rst iat=178, 196, r3=5.000000, r4=5.500000, &end
# Atom 1: HB3 LYS 11, Atom 2: H GLY 12
 &rst iat=179, 196, r3=5.000000, r4=5.500000, &end
# Atom 1: QB LYS 11, Atom 2: H GLY 12
 &rst iat=-1, 196, r3=4.770000, r4=5.270000, igr1=178, 179, &end
# Atom 1: QB LYS 11, Atom 2: H GLU 68
 &rst iat=-1, 1058, r3=6.480000, r4=6.980000, igr1=178, 179, &end
# Atom 1: QB LYS 11, Atom 2: HA ALA 69
 &rst iat=-1, 1075, r3=6.880000, r4=7.380000, igr1=178, 179, &end
# Atom 1: HG2 LYS 11, Atom 2: H GLY 12
 &rst iat=181, 196, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 LYS 11, Atom 2: H GLY 12
 &rst iat=182, 196, r3=6.000000, r4=6.500000, &end
# Atom 1: QE LYS 11, Atom 2: H ALA 70
 &rst iat=-1, 1083, r3=7.000000, r4=7.500000, igr1=187, 188, &end
# Atom 1: QE LYS 11, Atom 2: QB ALA 70
 &rst iat=-1, -1, r3=8.000000, r4=8.500000, 
 igr1=187, 188, igr2=1087, 1088, 1089, &end
# Atom 1: H GLY 12, Atom 2: H MET 13
 &rst iat=196, 203, r3=4.300000, r4=4.800000, &end
# Atom 1: H GLY 12, Atom 2: QD PHE 67
 &rst iat=196, -1, r3=8.000000, r4=8.500000, igr2=1046, 1054, &end
# Atom 1: H GLY 12, Atom 2: H GLU 68
 &rst iat=196, 1058, r3=5.700000, r4=6.200000, &end
# Atom 1: H MET 13, Atom 2: QG MET 13
 &rst iat=203, -1, r3=5.700000, r4=6.200000, igr2=210, 211, &end
# Atom 1: H MET 13, Atom 2: QE MET 13
 &rst iat=203, -1, r3=5.700000, r4=6.200000, igr2=216, 217, 218, &end
# Atom 1: H MET 13, Atom 2: QD ILE 22
 &rst iat=203, -1, r3=7.000000, r4=7.500000, igr2=337, 338, 339, &end
# Atom 1: H MET 13, Atom 2: QQD LEU 39
 &rst iat=203, -1, r3=7.770000, r4=8.270000, igr2=602, 603, 604, 606, 607, 608, &end
# Atom 1: H MET 13, Atom 2: QB PHE 67
 &rst iat=203, -1, r3=6.880000, r4=7.380000, igr2=1042, 1043, &end
# Atom 1: H MET 13, Atom 2: QD PHE 67
 &rst iat=203, -1, r3=8.000000, r4=8.500000, igr2=1046, 1054, &end
# Atom 1: H MET 13, Atom 2: QE PHE 67
 &rst iat=203, -1, r3=8.000000, r4=8.500000, igr2=1048, 1052, &end
# Atom 1: H MET 13, Atom 2: H GLU 68
 &rst iat=203, 1058, r3=6.000000, r4=6.500000, &end
# Atom 1: QB MET 13, Atom 2: H CYS 18
 &rst iat=-1, 270, r3=7.000000, r4=7.500000, igr1=207, 208, &end
# Atom 1: QE MET 13, Atom 2: H GLY 42
 &rst iat=-1, 641, r3=5.000000, r4=5.500000, igr1=216, 217, 218, &end
# Atom 1: QE MET 13, Atom 2: H LYS 43
 &rst iat=-1, 648, r3=5.600000, r4=6.100000, igr1=216, 217, 218, &end
# Atom 1: H THR 14, Atom 2: H CYS 15
 &rst iat=222, 236, r3=6.000000, r4=6.500000, &end
# Atom 1: HB THR 14, Atom 2: H CYS 15
 &rst iat=226, 236, r3=3.300000, r4=3.800000, &end
# Atom 1: H CYS 15, Atom 2: H CYS 18
 &rst iat=236, 270, r3=6.000000, r4=6.500000, &end
# Atom 1: H CYS 15, Atom 2: H SER 20
 &rst iat=236, 299, r3=6.000000, r4=6.500000, &end
# Atom 1: H SER 17, Atom 2: H CYS 18
 &rst iat=259, 270, r3=3.800000, r4=4.300000, &end
# Atom 1: H SER 17, Atom 2: H SER 20
 &rst iat=259, 299, r3=5.500000, r4=6.000000, &end
# Atom 1: HA SER 17, Atom 2: H VAL 19
 &rst iat=261, 283, r3=5.000000, r4=5.500000, &end
# Atom 1: HB2 SER 17, Atom 2: H CYS 18
 &rst iat=263, 270, r3=4.500000, r4=5.000000, &end
# Atom 1: HB3 SER 17, Atom 2: H CYS 18
 &rst iat=264, 270, r3=4.500000, r4=5.000000, &end
# Atom 1: QB SER 17, Atom 2: H VAL 19
 &rst iat=-1, 283, r3=6.080000, r4=6.580000, igr1=263, 264, &end
# Atom 1: QB SER 17, Atom 2: H SER 20
 &rst iat=-1, 299, r3=6.880000, r4=7.380000, igr1=263, 264, &end
# Atom 1: H CYS 18, Atom 2: H VAL 19
 &rst iat=270, 283, r3=4.100000, r4=4.600000, &end
# Atom 1: H CYS 18, Atom 2: HB VAL 19
 &rst iat=270, 287, r3=5.100000, r4=5.600000, &end
# Atom 1: H CYS 18, Atom 2: QG1 VAL 19
 &rst iat=270, -1, r3=7.000000, r4=7.500000, igr2=289, 290, 291, &end
# Atom 1: H CYS 18, Atom 2: QG2 VAL 19
 &rst iat=270, -1, r3=7.000000, r4=7.500000, igr2=293, 294, 295, &end
# Atom 1: H CYS 18, Atom 2: H SER 20
 &rst iat=270, 299, r3=5.700000, r4=6.200000, &end
# Atom 1: H CYS 18, Atom 2: QQD LEU 39
 &rst iat=270, -1, r3=8.570000, r4=9.070000, igr2=602, 603, 604, 606, 607, 608, &end
# Atom 1: HA CYS 18, Atom 2: H ASN 21
 &rst iat=272, 310, r3=4.700000, r4=5.200000, &end
# Atom 1: HA CYS 18, Atom 2: HND1 ASN 21
 &rst iat=272, 319, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 18, Atom 2: HND2 ASN 21
 &rst iat=272, 320, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 18, Atom 2: QND ASN 21
 &rst iat=272, -1, r3=5.690000, r4=6.190000, igr2=319, 320, &end
# Atom 1: QB CYS 18, Atom 2: H VAL 19
 &rst iat=-1, 283, r3=5.680000, r4=6.180000, igr1=274, 275, &end
# Atom 1: H VAL 19, Atom 2: HB VAL 19
 &rst iat=283, 287, r3=3.800000, r4=4.300000, &end
# Atom 1: H VAL 19, Atom 2: H SER 20
 &rst iat=283, 299, r3=3.800000, r4=4.300000, &end
# Atom 1: H VAL 19, Atom 2: QB SER 20
 &rst iat=283, -1, r3=7.000000, r4=7.500000, igr2=303, 304, &end
# Atom 1: H VAL 19, Atom 2: H ASN 21
 &rst iat=283, 310, r3=4.400000, r4=4.900000, &end
# Atom 1: H VAL 19, Atom 2: HB ILE 22
 &rst iat=283, 328, r3=6.000000, r4=6.500000, &end
# Atom 1: H VAL 19, Atom 2: QD ILE 22
 &rst iat=283, -1, r3=7.000000, r4=7.500000, igr2=337, 338, 339, &end
# Atom 1: H VAL 19, Atom 2: QB LEU 39
 &rst iat=283, -1, r3=6.880000, r4=7.380000, igr2=597, 598, &end
# Atom 1: H VAL 19, Atom 2: QQD LEU 39
 &rst iat=283, -1, r3=8.570000, r4=9.070000, igr2=602, 603, 604, 606, 607, 608, &end
# Atom 1: H VAL 19, Atom 2: HZ PHE 67
 &rst iat=283, 1050, r3=6.000000, r4=6.500000, &end
# Atom 1: HA VAL 19, Atom 2: H ILE 22
 &rst iat=285, 324, r3=4.100000, r4=4.600000, &end
# Atom 1: HB VAL 19, Atom 2: H SER 20
 &rst iat=287, 299, r3=3.600000, r4=4.100000, &end
# Atom 1: QG1 VAL 19, Atom 2: H SER 20
 &rst iat=-1, 299, r3=6.300000, r4=6.800000, igr1=289, 290, 291, &end
# Atom 1: QG2 VAL 19, Atom 2: H SER 20
 &rst iat=-1, 299, r3=6.300000, r4=6.800000, igr1=293, 294, 295, &end
# Atom 1: QQG VAL 19, Atom 2: H SER 20
 &rst iat=-1, 299, r3=5.950000, r4=6.450000, igr1=289, 290, 291, 293, 294, 295, &end
# Atom 1: QQG VAL 19, Atom 2: H ASN 21
 &rst iat=-1, 310, r3=8.560000, r4=9.060000, igr1=289, 290, 291, 293, 294, 295, &end
# Atom 1: QQG VAL 19, Atom 2: H GLU 23
 &rst iat=-1, 343, r3=8.560000, r4=9.060000, igr1=289, 290, 291, 293, 294, 295, &end
# Atom 1: QQG VAL 19, Atom 2: H VAL 37
 &rst iat=-1, 567, r3=8.560000, r4=9.060000, igr1=289, 290, 291, 293, 294, 295, &end
# Atom 1: QQG VAL 19, Atom 2: H LEU 39
 &rst iat=-1, 593, r3=8.560000, r4=9.060000, igr1=289, 290, 291, 293, 294, 295, &end
# Atom 1: H SER 20, Atom 2: QB ASN 21
 &rst iat=299, -1, r3=5.680000, r4=6.180000, igr2=314, 315, &end
# Atom 1: H SER 20, Atom 2: H ILE 22
 &rst iat=299, 324, r3=4.200000, r4=4.700000, &end
# Atom 1: H SER 20, Atom 2: HB ILE 22
 &rst iat=299, 328, r3=6.000000, r4=6.500000, &end
# Atom 1: H SER 20, Atom 2: H GLU 23
 &rst iat=299, 343, r3=6.000000, r4=6.500000, &end
# Atom 1: H SER 20, Atom 2: QB GLU 23
 &rst iat=299, -1, r3=6.880000, r4=7.380000, igr2=347, 348, &end
# Atom 1: H SER 20, Atom 2: QB LEU 39
 &rst iat=299, -1, r3=6.880000, r4=7.380000, igr2=597, 598, &end
# Atom 1: H SER 20, Atom 2: QQD LEU 39
 &rst iat=299, -1, r3=8.570000, r4=9.070000, igr2=602, 603, 604, 606, 607, 608, &end
# Atom 1: H SER 20, Atom 2: HZ PHE 67
 &rst iat=299, 1050, r3=6.000000, r4=6.500000, &end
# Atom 1: HA SER 20, Atom 2: H GLU 23
 &rst iat=301, 343, r3=5.200000, r4=5.700000, &end
# Atom 1: HA SER 20, Atom 2: H ARG 24
 &rst iat=301, 358, r3=5.500000, r4=6.000000, &end
# Atom 1: QB SER 20, Atom 2: QND ASN 21
 &rst iat=-1, -1, r3=7.870000, r4=8.370000, 
 igr1=303, 304, igr2=319, 320, &end
# Atom 1: QB SER 20, Atom 2: H GLU 23
 &rst iat=-1, 343, r3=7.000000, r4=7.500000, igr1=303, 304, &end
# Atom 1: H ASN 21, Atom 2: QB ASN 21
 &rst iat=310, -1, r3=3.590000, r4=4.090000, igr2=314, 315, &end
# Atom 1: H ASN 21, Atom 2: HND1 ASN 21
 &rst iat=310, 319, r3=5.500000, r4=6.000000, &end
# Atom 1: H ASN 21, Atom 2: HND2 ASN 21
 &rst iat=310, 320, r3=5.500000, r4=6.000000, &end
# Atom 1: H ASN 21, Atom 2: QND ASN 21
 &rst iat=310, -1, r3=5.140000, r4=5.640000, igr2=319, 320, &end
# Atom 1: H ASN 21, Atom 2: HB ILE 22
 &rst iat=310, 328, r3=4.400000, r4=4.900000, &end
# Atom 1: H ASN 21, Atom 2: QG1 ILE 22
 &rst iat=310, -1, r3=6.880000, r4=7.380000, igr2=334, 335, &end
# Atom 1: H ASN 21, Atom 2: H GLU 23
 &rst iat=310, 343, r3=5.600000, r4=6.100000, &end
# Atom 1: HA ASN 21, Atom 2: HND1 ASN 21
 &rst iat=312, 319, r3=5.900000, r4=6.400000, &end
# Atom 1: HA ASN 21, Atom 2: HND2 ASN 21
 &rst iat=312, 320, r3=5.900000, r4=6.400000, &end
# Atom 1: HA ASN 21, Atom 2: H ARG 24
 &rst iat=312, 358, r3=5.700000, r4=6.200000, &end
# Atom 1: HA ASN 21, Atom 2: HND1 ASN 25
 &rst iat=312, 391, r3=5.300000, r4=5.800000, &end
# Atom 1: HA ASN 21, Atom 2: HND2 ASN 25
 &rst iat=312, 392, r3=5.300000, r4=5.800000, &end
# Atom 1: HA ASN 21, Atom 2: QND ASN 25
 &rst iat=312, -1, r3=5.130000, r4=5.630000, igr2=391, 392, &end
# Atom 1: HB2 ASN 21, Atom 2: HND1 ASN 25
 &rst iat=314, 391, r3=7.750000, r4=8.250000, &end
# Atom 1: HB2 ASN 21, Atom 2: HND2 ASN 25
 &rst iat=314, 392, r3=7.750000, r4=8.250000, &end
# Atom 1: HB3 ASN 21, Atom 2: HND1 ASN 25
 &rst iat=315, 391, r3=7.750000, r4=8.250000, &end
# Atom 1: HB3 ASN 21, Atom 2: HND2 ASN 25
 &rst iat=315, 392, r3=7.750000, r4=8.250000, &end
# Atom 1: QB ASN 21, Atom 2: H ILE 22
 &rst iat=-1, 324, r3=4.380000, r4=4.880000, igr1=314, 315, &end
# Atom 1: QB ASN 21, Atom 2: QND ASN 25
 &rst iat=-1, -1, r3=6.570000, r4=7.070000, 
 igr1=314, 315, igr2=391, 392, &end
# Atom 1: HND1 ASN 21, Atom 2: HND1 ASN 25
 &rst iat=319, 391, r3=6.830000, r4=7.330000, &end
# Atom 1: HND1 ASN 21, Atom 2: HND2 ASN 25
 &rst iat=319, 392, r3=6.830000, r4=7.330000, &end
# Atom 1: HND1 ASN 21, Atom 2: HB2 LEU 65
 &rst iat=319, 1016, r3=7.730000, r4=8.230000, &end
# Atom 1: HND1 ASN 21, Atom 2: HB3 LEU 65
 &rst iat=319, 1017, r3=7.730000, r4=8.230000, &end
# Atom 1: HND1 ASN 21, Atom 2: QD1 LEU 65
 &rst iat=319, -1, r3=7.000000, r4=7.500000, igr2=1021, 1022, 1023, &end
# Atom 1: HND1 ASN 21, Atom 2: QD2 LEU 65
 &rst iat=319, -1, r3=7.000000, r4=7.500000, igr2=1025, 1026, 1027, &end
# Atom 1: HND2 ASN 21, Atom 2: HND1 ASN 25
 &rst iat=320, 391, r3=6.830000, r4=7.330000, &end
# Atom 1: HND2 ASN 21, Atom 2: HND2 ASN 25
 &rst iat=320, 392, r3=6.830000, r4=7.330000, &end
# Atom 1: HND2 ASN 21, Atom 2: HB2 LEU 65
 &rst iat=320, 1016, r3=7.730000, r4=8.230000, &end
# Atom 1: HND2 ASN 21, Atom 2: HB3 LEU 65
 &rst iat=320, 1017, r3=7.730000, r4=8.230000, &end
# Atom 1: HND2 ASN 21, Atom 2: QD1 LEU 65
 &rst iat=320, -1, r3=7.000000, r4=7.500000, igr2=1021, 1022, 1023, &end
# Atom 1: HND2 ASN 21, Atom 2: QD2 LEU 65
 &rst iat=320, -1, r3=7.000000, r4=7.500000, igr2=1025, 1026, 1027, &end
# Atom 1: QND ASN 21, Atom 2: H ILE 22
 &rst iat=-1, 324, r3=6.870000, r4=7.370000, igr1=319, 320, &end
# Atom 1: QND ASN 21, Atom 2: HB ILE 22
 &rst iat=-1, 328, r3=6.870000, r4=7.370000, igr1=319, 320, &end
# Atom 1: QND ASN 21, Atom 2: QD ILE 22
 &rst iat=-1, -1, r3=7.870000, r4=8.370000, 
 igr1=319, 320, igr2=337, 338, 339, &end
# Atom 1: QND ASN 21, Atom 2: QND ASN 25
 &rst iat=-1, -1, r3=6.110000, r4=6.610000, 
 igr1=319, 320, igr2=391, 392, &end
# Atom 1: QND ASN 21, Atom 2: QB LEU 65
 &rst iat=-1, -1, r3=6.810000, r4=7.310000, 
 igr1=319, 320, igr2=1016, 1017, &end
# Atom 1: QND ASN 21, Atom 2: HG LEU 65
 &rst iat=-1, 1019, r3=6.670000, r4=7.170000, igr1=319, 320, &end
# Atom 1: QND ASN 21, Atom 2: QQD LEU 65
 &rst iat=-1, -1, r3=6.000000, r4=6.500000, 
 igr1=319, 320, igr2=1021, 1022, 1023, 1025, 1026, 1027, &end
# Atom 1: QND ASN 21, Atom 2: QE PHE 67
 &rst iat=-1, -1, r3=8.870000, r4=9.370000, 
 igr1=319, 320, igr2=1048, 1052, &end
# Atom 1: H ILE 22, Atom 2: HB ILE 22
 &rst iat=324, 328, r3=3.600000, r4=4.100000, &end
# Atom 1: H ILE 22, Atom 2: HG12 ILE 22
 &rst iat=324, 334, r3=4.300000, r4=4.800000, &end
# Atom 1: H ILE 22, Atom 2: HG13 ILE 22
 &rst iat=324, 335, r3=4.300000, r4=4.800000, &end
# Atom 1: H ILE 22, Atom 2: QD ILE 22
 &rst iat=324, -1, r3=5.200000, r4=5.700000, igr2=337, 338, 339, &end
# Atom 1: H ILE 22, Atom 2: H GLU 23
 &rst iat=324, 343, r3=3.700000, r4=4.200000, &end
# Atom 1: H ILE 22, Atom 2: H ARG 24
 &rst iat=324, 358, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 22, Atom 2: HND1 ASN 25
 &rst iat=324, 391, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 22, Atom 2: HND2 ASN 25
 &rst iat=324, 392, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 22, Atom 2: QQG VAL 37
 &rst iat=324, -1, r3=8.560000, r4=9.060000, igr2=573, 574, 575, 577, 578, 579, &end
# Atom 1: H ILE 22, Atom 2: QD1 LEU 65
 &rst iat=324, -1, r3=6.400000, r4=6.900000, igr2=1021, 1022, 1023, &end
# Atom 1: H ILE 22, Atom 2: QD2 LEU 65
 &rst iat=324, -1, r3=6.400000, r4=6.900000, igr2=1025, 1026, 1027, &end
# Atom 1: H ILE 22, Atom 2: QQD LEU 65
 &rst iat=324, -1, r3=5.620000, r4=6.120000, igr2=1021, 1022, 1023, 1025, 1026, 1027, &end
# Atom 1: HA ILE 22, Atom 2: H ARG 24
 &rst iat=326, 358, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ILE 22, Atom 2: H ASN 25
 &rst iat=326, 382, r3=4.400000, r4=4.900000, &end
# Atom 1: HA ILE 22, Atom 2: H LEU 26
 &rst iat=326, 396, r3=5.000000, r4=5.500000, &end
# Atom 1: HB ILE 22, Atom 2: H GLU 23
 &rst iat=328, 343, r3=4.500000, r4=5.000000, &end
# Atom 1: QG2 ILE 22, Atom 2: H GLU 23
 &rst iat=-1, 343, r3=6.300000, r4=6.800000, igr1=330, 331, 332, &end
# Atom 1: QG2 ILE 22, Atom 2: H ARG 24
 &rst iat=-1, 358, r3=7.000000, r4=7.500000, igr1=330, 331, 332, &end
# Atom 1: QG2 ILE 22, Atom 2: H ASN 25
 &rst iat=-1, 382, r3=7.000000, r4=7.500000, igr1=330, 331, 332, &end
# Atom 1: QG2 ILE 22, Atom 2: H LEU 26
 &rst iat=-1, 396, r3=6.300000, r4=6.800000, igr1=330, 331, 332, &end
# Atom 1: QD ILE 22, Atom 2: H GLU 23
 &rst iat=-1, 343, r3=7.000000, r4=7.500000, igr1=337, 338, 339, &end
# Atom 1: H GLU 23, Atom 2: HB2 GLU 23
 &rst iat=343, 347, r3=3.700000, r4=4.200000, &end
# Atom 1: H GLU 23, Atom 2: HB3 GLU 23
 &rst iat=343, 348, r3=3.700000, r4=4.200000, &end
# Atom 1: H GLU 23, Atom 2: QG GLU 23
 &rst iat=343, -1, r3=4.480000, r4=4.980000, igr2=350, 351, &end
# Atom 1: H GLU 23, Atom 2: H ASN 25
 &rst iat=343, 382, r3=4.700000, r4=5.200000, &end
# Atom 1: H GLU 23, Atom 2: H LEU 26
 &rst iat=343, 396, r3=5.700000, r4=6.200000, &end
# Atom 1: H GLU 23, Atom 2: QQD LEU 26
 &rst iat=343, -1, r3=7.170000, r4=7.670000, igr2=405, 406, 407, 409, 410, 411, &end
# Atom 1: H GLU 23, Atom 2: QQG VAL 37
 &rst iat=343, -1, r3=7.860000, r4=8.360000, igr2=573, 574, 575, 577, 578, 579, &end
# Atom 1: HA GLU 23, Atom 2: H ASN 25
 &rst iat=345, 382, r3=5.100000, r4=5.600000, &end
# Atom 1: HA GLU 23, Atom 2: H LEU 26
 &rst iat=345, 396, r3=5.600000, r4=6.100000, &end
# Atom 1: HA GLU 23, Atom 2: H GLN 27
 &rst iat=345, 415, r3=5.700000, r4=6.200000, &end
# Atom 1: HA GLU 23, Atom 2: HNE1 GLN 27
 &rst iat=345, 427, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLU 23, Atom 2: HNE2 GLN 27
 &rst iat=345, 428, r3=6.000000, r4=6.500000, &end
# Atom 1: QB GLU 23, Atom 2: H ASN 25
 &rst iat=-1, 382, r3=6.680000, r4=7.180000, igr1=347, 348, &end
# Atom 1: QB GLU 23, Atom 2: H VAL 37
 &rst iat=-1, 567, r3=6.880000, r4=7.380000, igr1=347, 348, &end
# Atom 1: QG GLU 23, Atom 2: H ARG 24
 &rst iat=-1, 358, r3=6.880000, r4=7.380000, igr1=350, 351, &end
# Atom 1: QG GLU 23, Atom 2: H ASN 25
 &rst iat=-1, 382, r3=6.880000, r4=7.380000, igr1=350, 351, &end
# Atom 1: QG GLU 23, Atom 2: H VAL 37
 &rst iat=-1, 567, r3=6.880000, r4=7.380000, igr1=350, 351, &end
# Atom 1: H ARG 24, Atom 2: HB2 ARG 24
 &rst iat=358, 362, r3=3.800000, r4=4.300000, &end
# Atom 1: H ARG 24, Atom 2: HB3 ARG 24
 &rst iat=358, 363, r3=3.800000, r4=4.300000, &end
# Atom 1: H ARG 24, Atom 2: QB ARG 24
 &rst iat=358, -1, r3=3.500000, r4=4.000000, igr2=362, 363, &end
# Atom 1: H ARG 24, Atom 2: HG2 ARG 24
 &rst iat=358, 365, r3=4.200000, r4=4.700000, &end
# Atom 1: H ARG 24, Atom 2: HG3 ARG 24
 &rst iat=358, 366, r3=4.200000, r4=4.700000, &end
# Atom 1: H ARG 24, Atom 2: QD ARG 24
 &rst iat=358, -1, r3=6.500000, r4=7.000000, igr2=368, 369, &end
# Atom 1: H ARG 24, Atom 2: H ASN 25
 &rst iat=358, 382, r3=3.800000, r4=4.300000, &end
# Atom 1: H ARG 24, Atom 2: HB2 ASN 25
 &rst iat=358, 386, r3=6.000000, r4=6.500000, &end
# Atom 1: H ARG 24, Atom 2: HB3 ASN 25
 &rst iat=358, 387, r3=6.000000, r4=6.500000, &end
# Atom 1: H ARG 24, Atom 2: QB ASN 25
 &rst iat=358, -1, r3=5.640000, r4=6.140000, igr2=386, 387, &end
# Atom 1: H ARG 24, Atom 2: HND1 ASN 25
 &rst iat=358, 391, r3=6.000000, r4=6.500000, &end
# Atom 1: H ARG 24, Atom 2: HND2 ASN 25
 &rst iat=358, 392, r3=6.000000, r4=6.500000, &end
# Atom 1: H ARG 24, Atom 2: HNE1 GLN 27
 &rst iat=358, 427, r3=6.000000, r4=6.500000, &end
# Atom 1: H ARG 24, Atom 2: HNE2 GLN 27
 &rst iat=358, 428, r3=6.000000, r4=6.500000, &end
# Atom 1: H ARG 24, Atom 2: QQG VAL 35
 &rst iat=358, -1, r3=8.560000, r4=9.060000, igr2=538, 539, 540, 542, 543, 544, &end
# Atom 1: HA ARG 24, Atom 2: H GLN 27
 &rst iat=360, 415, r3=5.100000, r4=5.600000, &end
# Atom 1: HA ARG 24, Atom 2: HNE1 GLN 27
 &rst iat=360, 427, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ARG 24, Atom 2: HNE2 GLN 27
 &rst iat=360, 428, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ARG 24, Atom 2: H LYS 28
 &rst iat=360, 432, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 ARG 24, Atom 2: H ASN 25
 &rst iat=362, 382, r3=4.000000, r4=4.500000, &end
# Atom 1: HB2 ARG 24, Atom 2: HND1 ASN 25
 &rst iat=362, 391, r3=7.750000, r4=8.250000, &end
# Atom 1: HB2 ARG 24, Atom 2: HND2 ASN 25
 &rst iat=362, 392, r3=7.750000, r4=8.250000, &end
# Atom 1: HB2 ARG 24, Atom 2: HNE1 GLN 27
 &rst iat=362, 427, r3=7.750000, r4=8.250000, &end
# Atom 1: HB2 ARG 24, Atom 2: HNE2 GLN 27
 &rst iat=362, 428, r3=7.750000, r4=8.250000, &end
# Atom 1: HB3 ARG 24, Atom 2: H ASN 25
 &rst iat=363, 382, r3=4.000000, r4=4.500000, &end
# Atom 1: HB3 ARG 24, Atom 2: HND1 ASN 25
 &rst iat=363, 391, r3=7.750000, r4=8.250000, &end
# Atom 1: HB3 ARG 24, Atom 2: HND2 ASN 25
 &rst iat=363, 392, r3=7.750000, r4=8.250000, &end
# Atom 1: HB3 ARG 24, Atom 2: HNE1 GLN 27
 &rst iat=363, 427, r3=7.750000, r4=8.250000, &end
# Atom 1: HB3 ARG 24, Atom 2: HNE2 GLN 27
 &rst iat=363, 428, r3=7.750000, r4=8.250000, &end
# Atom 1: QB ARG 24, Atom 2: QND ASN 25
 &rst iat=-1, -1, r3=6.820000, r4=7.320000, 
 igr1=362, 363, igr2=391, 392, &end
# Atom 1: QB ARG 24, Atom 2: H LEU 26
 &rst iat=-1, 396, r3=6.080000, r4=6.580000, igr1=362, 363, &end
# Atom 1: QB ARG 24, Atom 2: QNE GLN 27
 &rst iat=-1, -1, r3=6.820000, r4=7.320000, 
 igr1=362, 363, igr2=427, 428, &end
# Atom 1: HG2 ARG 24, Atom 2: HND1 ASN 25
 &rst iat=365, 391, r3=7.730000, r4=8.230000, &end
# Atom 1: HG2 ARG 24, Atom 2: HND2 ASN 25
 &rst iat=365, 392, r3=7.730000, r4=8.230000, &end
# Atom 1: HG2 ARG 24, Atom 2: HNE1 GLN 27
 &rst iat=365, 427, r3=7.050000, r4=7.550000, &end
# Atom 1: HG2 ARG 24, Atom 2: HNE2 GLN 27
 &rst iat=365, 428, r3=7.050000, r4=7.550000, &end
# Atom 1: HG3 ARG 24, Atom 2: HND1 ASN 25
 &rst iat=366, 391, r3=7.730000, r4=8.230000, &end
# Atom 1: HG3 ARG 24, Atom 2: HND2 ASN 25
 &rst iat=366, 392, r3=7.730000, r4=8.230000, &end
# Atom 1: HG3 ARG 24, Atom 2: HNE1 GLN 27
 &rst iat=366, 427, r3=7.050000, r4=7.550000, &end
# Atom 1: HG3 ARG 24, Atom 2: HNE2 GLN 27
 &rst iat=366, 428, r3=7.050000, r4=7.550000, &end
# Atom 1: QG ARG 24, Atom 2: H ASN 25
 &rst iat=-1, 382, r3=6.480000, r4=6.980000, igr1=365, 366, &end
# Atom 1: QG ARG 24, Atom 2: QND ASN 25
 &rst iat=-1, -1, r3=6.360000, r4=6.860000, 
 igr1=365, 366, igr2=391, 392, &end
# Atom 1: QG ARG 24, Atom 2: QNE GLN 27
 &rst iat=-1, -1, r3=6.150000, r4=6.650000, 
 igr1=365, 366, igr2=427, 428, &end
# Atom 1: QD ARG 24, Atom 2: H ASN 25
 &rst iat=-1, 382, r3=7.000000, r4=7.500000, igr1=368, 369, &end
# Atom 1: H ASN 25, Atom 2: HB2 ASN 25
 &rst iat=382, 386, r3=3.800000, r4=4.300000, &end
# Atom 1: H ASN 25, Atom 2: HB3 ASN 25
 &rst iat=382, 387, r3=3.800000, r4=4.300000, &end
# Atom 1: H ASN 25, Atom 2: QB ASN 25
 &rst iat=382, -1, r3=3.600000, r4=4.100000, igr2=386, 387, &end
# Atom 1: H ASN 25, Atom 2: HND1 ASN 25
 &rst iat=382, 391, r3=4.400000, r4=4.900000, &end
# Atom 1: H ASN 25, Atom 2: HND2 ASN 25
 &rst iat=382, 392, r3=4.400000, r4=4.900000, &end
# Atom 1: H ASN 25, Atom 2: QND ASN 25
 &rst iat=382, -1, r3=4.210000, r4=4.710000, igr2=391, 392, &end
# Atom 1: H ASN 25, Atom 2: H LEU 26
 &rst iat=382, 396, r3=3.600000, r4=4.100000, &end
# Atom 1: H ASN 25, Atom 2: HA LEU 26
 &rst iat=382, 398, r3=5.600000, r4=6.100000, &end
# Atom 1: H ASN 25, Atom 2: QB LEU 26
 &rst iat=382, -1, r3=6.080000, r4=6.580000, igr2=400, 401, &end
# Atom 1: H ASN 25, Atom 2: QQD LEU 26
 &rst iat=382, -1, r3=8.570000, r4=9.070000, igr2=405, 406, 407, 409, 410, 411, &end
# Atom 1: H ASN 25, Atom 2: H LYS 28
 &rst iat=382, 432, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASN 25, Atom 2: QD1 LEU 65
 &rst iat=382, -1, r3=7.000000, r4=7.500000, igr2=1021, 1022, 1023, &end
# Atom 1: H ASN 25, Atom 2: QD2 LEU 65
 &rst iat=382, -1, r3=7.000000, r4=7.500000, igr2=1025, 1026, 1027, &end
# Atom 1: HA ASN 25, Atom 2: HND1 ASN 25
 &rst iat=384, 391, r3=5.100000, r4=5.600000, &end
# Atom 1: HA ASN 25, Atom 2: HND2 ASN 25
 &rst iat=384, 392, r3=5.100000, r4=5.600000, &end
# Atom 1: HA ASN 25, Atom 2: H GLN 27
 &rst iat=384, 415, r3=5.600000, r4=6.100000, &end
# Atom 1: HA ASN 25, Atom 2: H LYS 28
 &rst iat=384, 432, r3=5.300000, r4=5.800000, &end
# Atom 1: HB2 ASN 25, Atom 2: H LEU 26
 &rst iat=386, 396, r3=4.400000, r4=4.900000, &end
# Atom 1: HB3 ASN 25, Atom 2: H LEU 26
 &rst iat=387, 396, r3=4.400000, r4=4.900000, &end
# Atom 1: QB ASN 25, Atom 2: H LEU 26
 &rst iat=-1, 396, r3=4.210000, r4=4.710000, igr1=386, 387, &end
# Atom 1: QB ASN 25, Atom 2: H GLN 27
 &rst iat=-1, 415, r3=6.880000, r4=7.380000, igr1=386, 387, &end
# Atom 1: HND1 ASN 25, Atom 2: H LEU 26
 &rst iat=391, 396, r3=6.000000, r4=6.500000, &end
# Atom 1: HND1 ASN 25, Atom 2: QD1 LEU 65
 &rst iat=391, -1, r3=6.700000, r4=7.200000, igr2=1021, 1022, 1023, &end
# Atom 1: HND1 ASN 25, Atom 2: QD2 LEU 65
 &rst iat=391, -1, r3=6.700000, r4=7.200000, igr2=1025, 1026, 1027, &end
# Atom 1: HND2 ASN 25, Atom 2: H LEU 26
 &rst iat=392, 396, r3=6.000000, r4=6.500000, &end
# Atom 1: HND2 ASN 25, Atom 2: QD1 LEU 65
 &rst iat=392, -1, r3=6.700000, r4=7.200000, igr2=1021, 1022, 1023, &end
# Atom 1: HND2 ASN 25, Atom 2: QD2 LEU 65
 &rst iat=392, -1, r3=6.700000, r4=7.200000, igr2=1025, 1026, 1027, &end
# Atom 1: QND ASN 25, Atom 2: H LEU 26
 &rst iat=-1, 396, r3=5.550000, r4=6.050000, igr1=391, 392, &end
# Atom 1: QND ASN 25, Atom 2: QB LEU 26
 &rst iat=-1, -1, r3=7.740000, r4=8.240000, 
 igr1=391, 392, igr2=400, 401, &end
# Atom 1: QND ASN 25, Atom 2: QQD LEU 65
 &rst iat=-1, -1, r3=6.150000, r4=6.650000, 
 igr1=391, 392, igr2=1021, 1022, 1023, 1025, 1026, 1027, &end
# Atom 1: H LEU 26, Atom 2: HB2 LEU 26
 &rst iat=396, 400, r3=3.800000, r4=4.300000, &end
# Atom 1: H LEU 26, Atom 2: HB3 LEU 26
 &rst iat=396, 401, r3=3.800000, r4=4.300000, &end
# Atom 1: H LEU 26, Atom 2: QB LEU 26
 &rst iat=396, -1, r3=3.550000, r4=4.050000, igr2=400, 401, &end
# Atom 1: H LEU 26, Atom 2: HG LEU 26
 &rst iat=396, 403, r3=3.800000, r4=4.300000, &end
# Atom 1: H LEU 26, Atom 2: QD1 LEU 26
 &rst iat=396, -1, r3=6.000000, r4=6.500000, igr2=405, 406, 407, &end
# Atom 1: H LEU 26, Atom 2: QD2 LEU 26
 &rst iat=396, -1, r3=6.000000, r4=6.500000, igr2=409, 410, 411, &end
# Atom 1: H LEU 26, Atom 2: QQD LEU 26
 &rst iat=396, -1, r3=5.200000, r4=5.700000, igr2=405, 406, 407, 409, 410, 411, &end
# Atom 1: H LEU 26, Atom 2: H GLN 27
 &rst iat=396, 415, r3=3.600000, r4=4.100000, &end
# Atom 1: H LEU 26, Atom 2: QG GLN 27
 &rst iat=396, -1, r3=6.880000, r4=7.380000, igr2=422, 423, &end
# Atom 1: H LEU 26, Atom 2: H LYS 28
 &rst iat=396, 432, r3=5.700000, r4=6.200000, &end
# Atom 1: H LEU 26, Atom 2: H GLU 29
 &rst iat=396, 454, r3=5.700000, r4=6.200000, &end
# Atom 1: H LEU 26, Atom 2: QD PHE 61
 &rst iat=396, -1, r3=8.000000, r4=8.500000, igr2=952, 960, &end
# Atom 1: H LEU 26, Atom 2: QQD LEU 65
 &rst iat=396, -1, r3=8.570000, r4=9.070000, igr2=1021, 1022, 1023, 1025, 1026, 1027, &end
# Atom 1: HA LEU 26, Atom 2: H LYS 28
 &rst iat=398, 432, r3=5.200000, r4=5.700000, &end
# Atom 1: HA LEU 26, Atom 2: H GLU 29
 &rst iat=398, 454, r3=4.000000, r4=4.500000, &end
# Atom 1: HB2 LEU 26, Atom 2: H GLN 27
 &rst iat=400, 415, r3=4.100000, r4=4.600000, &end
# Atom 1: HB3 LEU 26, Atom 2: H GLN 27
 &rst iat=401, 415, r3=4.100000, r4=4.600000, &end
# Atom 1: QB LEU 26, Atom 2: H GLU 29
 &rst iat=-1, 454, r3=5.280000, r4=5.780000, igr1=400, 401, &end
# Atom 1: HG LEU 26, Atom 2: H GLN 27
 &rst iat=403, 415, r3=5.700000, r4=6.200000, &end
# Atom 1: HG LEU 26, Atom 2: H ILE 62
 &rst iat=403, 964, r3=6.000000, r4=6.500000, &end
# Atom 1: QD1 LEU 26, Atom 2: H GLN 27
 &rst iat=-1, 415, r3=6.100000, r4=6.600000, igr1=405, 406, 407, &end
# Atom 1: QD1 LEU 26, Atom 2: H GLU 29
 &rst iat=-1, 454, r3=7.000000, r4=7.500000, igr1=405, 406, 407, &end
# Atom 1: QD2 LEU 26, Atom 2: H GLN 27
 &rst iat=-1, 415, r3=6.100000, r4=6.600000, igr1=409, 410, 411, &end
# Atom 1: QD2 LEU 26, Atom 2: H GLU 29
 &rst iat=-1, 454, r3=7.000000, r4=7.500000, igr1=409, 410, 411, &end
# Atom 1: QQD LEU 26, Atom 2: H GLN 27
 &rst iat=-1, 415, r3=5.740000, r4=6.240000, igr1=405, 406, 407, 409, 410, 411, &end
# Atom 1: QQD LEU 26, Atom 2: H LYS 28
 &rst iat=-1, 432, r3=8.570000, r4=9.070000, igr1=405, 406, 407, 409, 410, 411, &end
# Atom 1: QQD LEU 26, Atom 2: H GLU 29
 &rst iat=-1, 454, r3=6.520000, r4=7.020000, igr1=405, 406, 407, 409, 410, 411, &end
# Atom 1: QQD LEU 26, Atom 2: H ILE 62
 &rst iat=-1, 964, r3=6.470000, r4=6.970000, igr1=405, 406, 407, 409, 410, 411, &end
# Atom 1: H GLN 27, Atom 2: HB2 GLN 27
 &rst iat=415, 419, r3=3.600000, r4=4.100000, &end
# Atom 1: H GLN 27, Atom 2: HB3 GLN 27
 &rst iat=415, 420, r3=3.600000, r4=4.100000, &end
# Atom 1: H GLN 27, Atom 2: QB GLN 27
 &rst iat=415, -1, r3=3.390000, r4=3.890000, igr2=419, 420, &end
# Atom 1: H GLN 27, Atom 2: HG2 GLN 27
 &rst iat=415, 422, r3=4.700000, r4=5.200000, &end
# Atom 1: H GLN 27, Atom 2: HG3 GLN 27
 &rst iat=415, 423, r3=4.700000, r4=5.200000, &end
# Atom 1: H GLN 27, Atom 2: QG GLN 27
 &rst iat=415, -1, r3=4.140000, r4=4.640000, igr2=422, 423, &end
# Atom 1: H GLN 27, Atom 2: QNE GLN 27
 &rst iat=415, -1, r3=3.970000, r4=4.470000, igr2=427, 428, &end
# Atom 1: H GLN 27, Atom 2: H LYS 28
 &rst iat=415, 432, r3=2.800000, r4=3.300000, &end
# Atom 1: H GLN 27, Atom 2: HA LYS 28
 &rst iat=415, 434, r3=5.800000, r4=6.300000, &end
# Atom 1: H GLN 27, Atom 2: H GLU 29
 &rst iat=415, 454, r3=4.500000, r4=5.000000, &end
# Atom 1: H GLN 27, Atom 2: QQG VAL 32
 &rst iat=415, -1, r3=8.560000, r4=9.060000, igr2=492, 493, 494, 496, 497, 498, &end
# Atom 1: H GLN 27, Atom 2: QG1 VAL 35
 &rst iat=415, -1, r3=6.300000, r4=6.800000, igr2=538, 539, 540, &end
# Atom 1: H GLN 27, Atom 2: QG2 VAL 35
 &rst iat=415, -1, r3=6.300000, r4=6.800000, igr2=542, 543, 544, &end
# Atom 1: H GLN 27, Atom 2: QQG VAL 35
 &rst iat=415, -1, r3=5.700000, r4=6.200000, igr2=538, 539, 540, 542, 543, 544, &end
# Atom 1: HA GLN 27, Atom 2: HNE1 GLN 27
 &rst iat=417, 427, r3=5.300000, r4=5.800000, &end
# Atom 1: HA GLN 27, Atom 2: HNE2 GLN 27
 &rst iat=417, 428, r3=5.300000, r4=5.800000, &end
# Atom 1: HA GLN 27, Atom 2: QNE GLN 27
 &rst iat=417, -1, r3=4.840000, r4=5.340000, igr2=427, 428, &end
# Atom 1: HA GLN 27, Atom 2: H GLU 29
 &rst iat=417, 454, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLN 27, Atom 2: H ALA 30
 &rst iat=417, 469, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 GLN 27, Atom 2: HNE1 GLN 27
 &rst iat=419, 427, r3=5.650000, r4=6.150000, &end
# Atom 1: HB2 GLN 27, Atom 2: HNE2 GLN 27
 &rst iat=419, 428, r3=5.650000, r4=6.150000, &end
# Atom 1: HB2 GLN 27, Atom 2: H LYS 28
 &rst iat=419, 432, r3=4.500000, r4=5.000000, &end
# Atom 1: HB3 GLN 27, Atom 2: HNE1 GLN 27
 &rst iat=420, 427, r3=5.650000, r4=6.150000, &end
# Atom 1: HB3 GLN 27, Atom 2: HNE2 GLN 27
 &rst iat=420, 428, r3=5.650000, r4=6.150000, &end
# Atom 1: HB3 GLN 27, Atom 2: H LYS 28
 &rst iat=420, 432, r3=4.500000, r4=5.000000, &end
# Atom 1: QB GLN 27, Atom 2: QNE GLN 27
 &rst iat=-1, -1, r3=4.520000, r4=5.020000, 
 igr1=419, 420, igr2=427, 428, &end
# Atom 1: QB GLN 27, Atom 2: H LYS 28
 &rst iat=-1, 432, r3=4.030000, r4=4.530000, igr1=419, 420, &end
# Atom 1: QB GLN 27, Atom 2: H GLU 29
 &rst iat=-1, 454, r3=6.880000, r4=7.380000, igr1=419, 420, &end
# Atom 1: HG2 GLN 27, Atom 2: H LYS 28
 &rst iat=422, 432, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLN 27, Atom 2: H LYS 28
 &rst iat=423, 432, r3=6.000000, r4=6.500000, &end
# Atom 1: QG GLN 27, Atom 2: H VAL 35
 &rst iat=-1, 532, r3=6.880000, r4=7.380000, igr1=422, 423, &end
# Atom 1: HNE1 GLN 27, Atom 2: HG2 LYS 28
 &rst iat=427, 439, r3=7.730000, r4=8.230000, &end
# Atom 1: HNE1 GLN 27, Atom 2: HG3 LYS 28
 &rst iat=427, 440, r3=7.730000, r4=8.230000, &end
# Atom 1: HNE1 GLN 27, Atom 2: QG1 VAL 32
 &rst iat=427, -1, r3=9.220000, r4=9.720000, igr2=492, 493, 494, &end
# Atom 1: HNE1 GLN 27, Atom 2: QG2 VAL 32
 &rst iat=427, -1, r3=9.220000, r4=9.720000, igr2=496, 497, 498, &end
# Atom 1: HNE1 GLN 27, Atom 2: HA SER 34
 &rst iat=427, 523, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE1 GLN 27, Atom 2: H VAL 35
 &rst iat=427, 532, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE1 GLN 27, Atom 2: HA VAL 35
 &rst iat=427, 534, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE1 GLN 27, Atom 2: QG1 VAL 35
 &rst iat=427, -1, r3=6.930000, r4=7.430000, igr2=538, 539, 540, &end
# Atom 1: HNE1 GLN 27, Atom 2: QG2 VAL 35
 &rst iat=427, -1, r3=6.930000, r4=7.430000, igr2=542, 543, 544, &end
# Atom 1: HNE2 GLN 27, Atom 2: HG2 LYS 28
 &rst iat=428, 439, r3=7.730000, r4=8.230000, &end
# Atom 1: HNE2 GLN 27, Atom 2: HG3 LYS 28
 &rst iat=428, 440, r3=7.730000, r4=8.230000, &end
# Atom 1: HNE2 GLN 27, Atom 2: QG1 VAL 32
 &rst iat=428, -1, r3=9.220000, r4=9.720000, igr2=492, 493, 494, &end
# Atom 1: HNE2 GLN 27, Atom 2: QG2 VAL 32
 &rst iat=428, -1, r3=9.220000, r4=9.720000, igr2=496, 497, 498, &end
# Atom 1: HNE2 GLN 27, Atom 2: HA SER 34
 &rst iat=428, 523, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE2 GLN 27, Atom 2: H VAL 35
 &rst iat=428, 532, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE2 GLN 27, Atom 2: HA VAL 35
 &rst iat=428, 534, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE2 GLN 27, Atom 2: QG1 VAL 35
 &rst iat=428, -1, r3=6.930000, r4=7.430000, igr2=538, 539, 540, &end
# Atom 1: HNE2 GLN 27, Atom 2: QG2 VAL 35
 &rst iat=428, -1, r3=6.930000, r4=7.430000, igr2=542, 543, 544, &end
# Atom 1: QNE GLN 27, Atom 2: QG LYS 28
 &rst iat=-1, -1, r3=6.810000, r4=7.310000, 
 igr1=427, 428, igr2=439, 440, &end
# Atom 1: QNE GLN 27, Atom 2: QQG VAL 32
 &rst iat=-1, -1, r3=7.460000, r4=7.960000, 
 igr1=427, 428, igr2=492, 493, 494, 496, 497, 498, &end
# Atom 1: QNE GLN 27, Atom 2: HA SER 34
 &rst iat=-1, 523, r3=5.790000, r4=6.290000, igr1=427, 428, &end
# Atom 1: QNE GLN 27, Atom 2: QQG VAL 35
 &rst iat=-1, -1, r3=5.660000, r4=6.160000, 
 igr1=427, 428, igr2=538, 539, 540, 542, 543, 544, &end
# Atom 1: H LYS 28, Atom 2: HG2 LYS 28
 &rst iat=432, 439, r3=4.000000, r4=4.500000, &end
# Atom 1: H LYS 28, Atom 2: HG3 LYS 28
 &rst iat=432, 440, r3=4.000000, r4=4.500000, &end
# Atom 1: H LYS 28, Atom 2: QD LYS 28
 &rst iat=432, -1, r3=5.400000, r4=5.900000, igr2=442, 443, &end
# Atom 1: H LYS 28, Atom 2: QE LYS 28
 &rst iat=432, -1, r3=7.000000, r4=7.500000, igr2=445, 446, &end
# Atom 1: H LYS 28, Atom 2: H GLU 29
 &rst iat=432, 454, r3=3.000000, r4=3.500000, &end
# Atom 1: H LYS 28, Atom 2: H ALA 30
 &rst iat=432, 469, r3=6.000000, r4=6.500000, &end
# Atom 1: H LYS 28, Atom 2: QQG VAL 32
 &rst iat=432, -1, r3=8.560000, r4=9.060000, igr2=492, 493, 494, 496, 497, 498, &end
# Atom 1: H LYS 28, Atom 2: QQG VAL 35
 &rst iat=432, -1, r3=8.560000, r4=9.060000, igr2=538, 539, 540, 542, 543, 544, &end
# Atom 1: HA LYS 28, Atom 2: H GLU 29
 &rst iat=434, 454, r3=3.500000, r4=4.000000, &end
# Atom 1: QB LYS 28, Atom 2: H GLU 29
 &rst iat=-1, 454, r3=4.600000, r4=5.100000, igr1=436, 437, &end
# Atom 1: QB LYS 28, Atom 2: H ALA 30
 &rst iat=-1, 469, r3=7.000000, r4=7.500000, igr1=436, 437, &end
# Atom 1: QG LYS 28, Atom 2: H GLU 29
 &rst iat=-1, 454, r3=6.880000, r4=7.380000, igr1=439, 440, &end
# Atom 1: H GLU 29, Atom 2: QB GLU 29
 &rst iat=454, -1, r3=3.300000, r4=3.800000, igr2=458, 459, &end
# Atom 1: H GLU 29, Atom 2: QG GLU 29
 &rst iat=454, -1, r3=6.880000, r4=7.380000, igr2=461, 462, &end
# Atom 1: H GLU 29, Atom 2: H ALA 30
 &rst iat=454, 469, r3=4.600000, r4=5.100000, &end
# Atom 1: H GLU 29, Atom 2: H VAL 32
 &rst iat=454, 486, r3=5.500000, r4=6.000000, &end
# Atom 1: H GLU 29, Atom 2: QQG VAL 32
 &rst iat=454, -1, r3=6.460000, r4=6.960000, igr2=492, 493, 494, 496, 497, 498, &end
# Atom 1: QB GLU 29, Atom 2: H GLY 31
 &rst iat=-1, 479, r3=7.000000, r4=7.500000, igr1=458, 459, &end
# Atom 1: QB GLU 29, Atom 2: H VAL 32
 &rst iat=-1, 486, r3=5.200000, r4=5.700000, igr1=458, 459, &end
# Atom 1: QG GLU 29, Atom 2: H ALA 30
 &rst iat=-1, 469, r3=6.880000, r4=7.380000, igr1=461, 462, &end
# Atom 1: H ALA 30, Atom 2: QA GLY 31
 &rst iat=469, -1, r3=6.680000, r4=7.180000, igr2=481, 482, &end
# Atom 1: H ALA 30, Atom 2: H VAL 32
 &rst iat=469, 486, r3=6.000000, r4=6.500000, &end
# Atom 1: H ALA 30, Atom 2: QG1 VAL 32
 &rst iat=469, -1, r3=7.000000, r4=7.500000, igr2=492, 493, 494, &end
# Atom 1: H ALA 30, Atom 2: QG2 VAL 32
 &rst iat=469, -1, r3=7.000000, r4=7.500000, igr2=496, 497, 498, &end
# Atom 1: H ALA 30, Atom 2: QQG VAL 52
 &rst iat=469, -1, r3=8.400000, r4=8.900000, igr2=804, 805, 806, 808, 809, 810, &end
# Atom 1: H ALA 30, Atom 2: HB ILE 53
 &rst iat=469, 818, r3=6.000000, r4=6.500000, &end
# Atom 1: H ALA 30, Atom 2: QG1 ILE 53
 &rst iat=469, -1, r3=7.000000, r4=7.500000, igr2=824, 825, &end
# Atom 1: H ALA 30, Atom 2: QD ILE 53
 &rst iat=469, -1, r3=7.000000, r4=7.500000, igr2=827, 828, 829, &end
# Atom 1: HA ALA 30, Atom 2: H GLY 31
 &rst iat=471, 479, r3=3.600000, r4=4.100000, &end
# Atom 1: HA ALA 30, Atom 2: H VAL 32
 &rst iat=471, 486, r3=4.500000, r4=5.000000, &end
# Atom 1: QB ALA 30, Atom 2: H VAL 32
 &rst iat=-1, 486, r3=6.100000, r4=6.600000, igr1=473, 474, 475, &end
# Atom 1: H GLY 31, Atom 2: H VAL 32
 &rst iat=479, 486, r3=3.600000, r4=4.100000, &end
# Atom 1: H GLY 31, Atom 2: HB VAL 32
 &rst iat=479, 490, r3=5.900000, r4=6.400000, &end
# Atom 1: H GLY 31, Atom 2: QQG VAL 32
 &rst iat=479, -1, r3=8.560000, r4=9.060000, igr2=492, 493, 494, 496, 497, 498, &end
# Atom 1: H GLY 31, Atom 2: QB TYR 48
 &rst iat=479, -1, r3=6.880000, r4=7.380000, igr2=740, 741, &end
# Atom 1: H GLY 31, Atom 2: H ASP 49
 &rst iat=479, 757, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 31, Atom 2: HB2 ASP 49
 &rst iat=479, 761, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 31, Atom 2: HB3 ASP 49
 &rst iat=479, 762, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 31, Atom 2: HB VAL 52
 &rst iat=479, 802, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 31, Atom 2: QQG VAL 52
 &rst iat=479, -1, r3=5.500000, r4=6.000000, igr2=804, 805, 806, 808, 809, 810, &end
# Atom 1: H GLY 31, Atom 2: HB ILE 53
 &rst iat=479, 818, r3=6.000000, r4=6.500000, &end
# Atom 1: HA2 GLY 31, Atom 2: H ASP 49
 &rst iat=481, 757, r3=6.000000, r4=6.500000, &end
# Atom 1: HA2 GLY 31, Atom 2: H ILE 53
 &rst iat=481, 814, r3=6.000000, r4=6.500000, &end
# Atom 1: HA3 GLY 31, Atom 2: H ASP 49
 &rst iat=482, 757, r3=6.000000, r4=6.500000, &end
# Atom 1: HA3 GLY 31, Atom 2: H ILE 53
 &rst iat=482, 814, r3=6.000000, r4=6.500000, &end
# Atom 1: QA GLY 31, Atom 2: H GLU 51
 &rst iat=-1, 783, r3=6.880000, r4=7.380000, igr1=481, 482, &end
# Atom 1: QA GLY 31, Atom 2: H VAL 52
 &rst iat=-1, 798, r3=6.880000, r4=7.380000, igr1=481, 482, &end
# Atom 1: QA GLY 31, Atom 2: H ILE 53
 &rst iat=-1, 814, r3=5.500000, r4=6.000000, igr1=481, 482, &end
# Atom 1: H VAL 32, Atom 2: HB VAL 32
 &rst iat=486, 490, r3=3.800000, r4=4.300000, &end
# Atom 1: H VAL 32, Atom 2: QG1 VAL 32
 &rst iat=486, -1, r3=4.900000, r4=5.400000, igr2=492, 493, 494, &end
# Atom 1: H VAL 32, Atom 2: QG2 VAL 32
 &rst iat=486, -1, r3=4.900000, r4=5.400000, igr2=496, 497, 498, &end
# Atom 1: H VAL 32, Atom 2: QQG VAL 32
 &rst iat=486, -1, r3=4.290000, r4=4.790000, igr2=492, 493, 494, 496, 497, 498, &end
# Atom 1: H VAL 32, Atom 2: H LEU 33
 &rst iat=486, 502, r3=4.600000, r4=5.100000, &end
# Atom 1: H VAL 32, Atom 2: HA TYR 48
 &rst iat=486, 738, r3=6.000000, r4=6.500000, &end
# Atom 1: H VAL 32, Atom 2: HB2 TYR 48
 &rst iat=486, 740, r3=6.000000, r4=6.500000, &end
# Atom 1: H VAL 32, Atom 2: HB3 TYR 48
 &rst iat=486, 741, r3=6.000000, r4=6.500000, &end
# Atom 1: H VAL 32, Atom 2: QB TYR 48
 &rst iat=486, -1, r3=5.740000, r4=6.240000, igr2=740, 741, &end
# Atom 1: H VAL 32, Atom 2: QQG VAL 52
 &rst iat=486, -1, r3=7.400000, r4=7.900000, igr2=804, 805, 806, 808, 809, 810, &end
# Atom 1: H VAL 32, Atom 2: HB ILE 53
 &rst iat=486, 818, r3=5.900000, r4=6.400000, &end
# Atom 1: H VAL 32, Atom 2: QG1 ILE 53
 &rst iat=486, -1, r3=7.000000, r4=7.500000, igr2=824, 825, &end
# Atom 1: H VAL 32, Atom 2: QD ILE 53
 &rst iat=486, -1, r3=5.800000, r4=6.300000, igr2=827, 828, 829, &end
# Atom 1: H VAL 32, Atom 2: QD ILE 58
 &rst iat=486, -1, r3=7.000000, r4=7.500000, igr2=911, 912, 913, &end
# Atom 1: HA VAL 32, Atom 2: H SER 34
 &rst iat=488, 521, r3=5.100000, r4=5.600000, &end
# Atom 1: HA VAL 32, Atom 2: H TYR 48
 &rst iat=488, 736, r3=6.000000, r4=6.500000, &end
# Atom 1: HA VAL 32, Atom 2: H ASP 49
 &rst iat=488, 757, r3=5.700000, r4=6.200000, &end
# Atom 1: HB VAL 32, Atom 2: H LEU 33
 &rst iat=490, 502, r3=5.400000, r4=5.900000, &end
# Atom 1: HB VAL 32, Atom 2: H SER 34
 &rst iat=490, 521, r3=6.000000, r4=6.500000, &end
# Atom 1: QG1 VAL 32, Atom 2: H LEU 33
 &rst iat=-1, 502, r3=7.000000, r4=7.500000, igr1=492, 493, 494, &end
# Atom 1: QG2 VAL 32, Atom 2: H LEU 33
 &rst iat=-1, 502, r3=7.000000, r4=7.500000, igr1=496, 497, 498, &end
# Atom 1: QQG VAL 32, Atom 2: H LEU 33
 &rst iat=-1, 502, r3=6.520000, r4=7.020000, igr1=492, 493, 494, 496, 497, 498, &end
# Atom 1: QQG VAL 32, Atom 2: H SER 34
 &rst iat=-1, 521, r3=7.060000, r4=7.560000, igr1=492, 493, 494, 496, 497, 498, &end
# Atom 1: QQG VAL 32, Atom 2: H VAL 35
 &rst iat=-1, 532, r3=8.560000, r4=9.060000, igr1=492, 493, 494, 496, 497, 498, &end
# Atom 1: QQG VAL 32, Atom 2: H LYS 47
 &rst iat=-1, 714, r3=7.360000, r4=7.860000, igr1=492, 493, 494, 496, 497, 498, &end
# Atom 1: QQG VAL 32, Atom 2: H ASP 49
 &rst iat=-1, 757, r3=8.460000, r4=8.960000, igr1=492, 493, 494, 496, 497, 498, &end
# Atom 1: H LEU 33, Atom 2: HG LEU 33
 &rst iat=502, 509, r3=4.300000, r4=4.800000, &end
# Atom 1: H LEU 33, Atom 2: QD1 LEU 33
 &rst iat=502, -1, r3=7.000000, r4=7.500000, igr2=511, 512, 513, &end
# Atom 1: H LEU 33, Atom 2: QD2 LEU 33
 &rst iat=502, -1, r3=7.000000, r4=7.500000, igr2=515, 516, 517, &end
# Atom 1: H LEU 33, Atom 2: QQD LEU 33
 &rst iat=502, -1, r3=5.920000, r4=6.420000, igr2=511, 512, 513, 515, 516, 517, &end
# Atom 1: H LEU 33, Atom 2: H SER 34
 &rst iat=502, 521, r3=4.600000, r4=5.100000, &end
# Atom 1: H LEU 33, Atom 2: QG1 ILE 46
 &rst iat=502, -1, r3=6.880000, r4=7.380000, igr2=705, 706, &end
# Atom 1: H LEU 33, Atom 2: H LYS 47
 &rst iat=502, 714, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 33, Atom 2: HA TYR 48
 &rst iat=502, 738, r3=5.100000, r4=5.600000, &end
# Atom 1: H LEU 33, Atom 2: HB2 TYR 48
 &rst iat=502, 740, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 33, Atom 2: HB3 TYR 48
 &rst iat=502, 741, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 33, Atom 2: QD TYR 48
 &rst iat=502, -1, r3=8.000000, r4=8.500000, igr2=744, 753, &end
# Atom 1: HB2 LEU 33, Atom 2: H SER 34
 &rst iat=506, 521, r3=4.800000, r4=5.300000, &end
# Atom 1: HB3 LEU 33, Atom 2: H SER 34
 &rst iat=507, 521, r3=4.800000, r4=5.300000, &end
# Atom 1: QB LEU 33, Atom 2: H SER 34
 &rst iat=-1, 521, r3=4.620000, r4=5.120000, igr1=506, 507, &end
# Atom 1: QQD LEU 33, Atom 2: H SER 34
 &rst iat=-1, 521, r3=7.370000, r4=7.870000, igr1=511, 512, 513, 515, 516, 517, &end
# Atom 1: H SER 34, Atom 2: HB2 SER 34
 &rst iat=521, 525, r3=4.000000, r4=4.500000, &end
# Atom 1: H SER 34, Atom 2: HB3 SER 34
 &rst iat=521, 526, r3=4.000000, r4=4.500000, &end
# Atom 1: H SER 34, Atom 2: QB SER 34
 &rst iat=521, -1, r3=3.800000, r4=4.300000, igr2=525, 526, &end
# Atom 1: H SER 34, Atom 2: H VAL 35
 &rst iat=521, 532, r3=4.600000, r4=5.100000, &end
# Atom 1: H SER 34, Atom 2: HA ILE 46
 &rst iat=521, 697, r3=5.700000, r4=6.200000, &end
# Atom 1: H SER 34, Atom 2: HB ILE 46
 &rst iat=521, 699, r3=6.000000, r4=6.500000, &end
# Atom 1: H SER 34, Atom 2: QG2 ILE 46
 &rst iat=521, -1, r3=6.800000, r4=7.300000, igr2=701, 702, 703, &end
# Atom 1: H SER 34, Atom 2: QG1 ILE 46
 &rst iat=521, -1, r3=6.880000, r4=7.380000, igr2=705, 706, &end
# Atom 1: H SER 34, Atom 2: H LYS 47
 &rst iat=521, 714, r3=4.800000, r4=5.300000, &end
# Atom 1: H SER 34, Atom 2: HB2 LYS 47
 &rst iat=521, 718, r3=6.000000, r4=6.500000, &end
# Atom 1: H SER 34, Atom 2: HB3 LYS 47
 &rst iat=521, 719, r3=6.000000, r4=6.500000, &end
# Atom 1: H SER 34, Atom 2: QB LYS 47
 &rst iat=521, -1, r3=5.840000, r4=6.340000, igr2=718, 719, &end
# Atom 1: H SER 34, Atom 2: QE LYS 47
 &rst iat=521, -1, r3=7.000000, r4=7.500000, igr2=727, 728, &end
# Atom 1: H SER 34, Atom 2: HA TYR 48
 &rst iat=521, 738, r3=5.400000, r4=5.900000, &end
# Atom 1: H SER 34, Atom 2: QB TYR 48
 &rst iat=521, -1, r3=6.880000, r4=7.380000, igr2=740, 741, &end
# Atom 1: HA SER 34, Atom 2: H VAL 35
 &rst iat=523, 532, r3=3.100000, r4=3.600000, &end
# Atom 1: HB2 SER 34, Atom 2: H VAL 35
 &rst iat=525, 532, r3=4.600000, r4=5.100000, &end
# Atom 1: HB2 SER 34, Atom 2: H LYS 47
 &rst iat=525, 714, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 SER 34, Atom 2: H VAL 35
 &rst iat=526, 532, r3=4.600000, r4=5.100000, &end
# Atom 1: HB3 SER 34, Atom 2: H LYS 47
 &rst iat=526, 714, r3=6.000000, r4=6.500000, &end
# Atom 1: QB SER 34, Atom 2: H VAL 35
 &rst iat=-1, 532, r3=4.420000, r4=4.920000, igr1=525, 526, &end
# Atom 1: QB SER 34, Atom 2: H LEU 36
 &rst iat=-1, 548, r3=6.880000, r4=7.380000, igr1=525, 526, &end
# Atom 1: H VAL 35, Atom 2: HB VAL 35
 &rst iat=532, 536, r3=3.600000, r4=4.100000, &end
# Atom 1: H VAL 35, Atom 2: H LEU 36
 &rst iat=532, 548, r3=4.500000, r4=5.000000, &end
# Atom 1: H VAL 35, Atom 2: HG LEU 36
 &rst iat=532, 555, r3=6.000000, r4=6.500000, &end
# Atom 1: H VAL 35, Atom 2: QG2 ILE 46
 &rst iat=532, -1, r3=7.000000, r4=7.500000, igr2=701, 702, 703, &end
# Atom 1: H VAL 35, Atom 2: QB LYS 47
 &rst iat=532, -1, r3=6.880000, r4=7.380000, igr2=718, 719, &end
# Atom 1: HA VAL 35, Atom 2: H LEU 36
 &rst iat=534, 548, r3=3.200000, r4=3.700000, &end
# Atom 1: HA VAL 35, Atom 2: H VAL 37
 &rst iat=534, 567, r3=6.000000, r4=6.500000, &end
# Atom 1: HA VAL 35, Atom 2: H GLU 45
 &rst iat=534, 680, r3=5.700000, r4=6.200000, &end
# Atom 1: HA VAL 35, Atom 2: H ILE 46
 &rst iat=534, 695, r3=6.000000, r4=6.500000, &end
# Atom 1: HA VAL 35, Atom 2: H LYS 47
 &rst iat=534, 714, r3=5.100000, r4=5.600000, &end
# Atom 1: HB VAL 35, Atom 2: H LEU 36
 &rst iat=536, 548, r3=6.000000, r4=6.500000, &end
# Atom 1: QG1 VAL 35, Atom 2: H LEU 36
 &rst iat=-1, 548, r3=6.200000, r4=6.700000, igr1=538, 539, 540, &end
# Atom 1: QG2 VAL 35, Atom 2: H LEU 36
 &rst iat=-1, 548, r3=6.200000, r4=6.700000, igr1=542, 543, 544, &end
# Atom 1: QQG VAL 35, Atom 2: H LEU 36
 &rst iat=-1, 548, r3=5.750000, r4=6.250000, igr1=538, 539, 540, 542, 543, 544, &end
# Atom 1: QQG VAL 35, Atom 2: H ILE 46
 &rst iat=-1, 695, r3=8.560000, r4=9.060000, igr1=538, 539, 540, 542, 543, 544, &end
# Atom 1: QQG VAL 35, Atom 2: H LYS 47
 &rst iat=-1, 714, r3=7.960000, r4=8.460000, igr1=538, 539, 540, 542, 543, 544, &end
# Atom 1: H LEU 36, Atom 2: HB2 LEU 36
 &rst iat=548, 552, r3=3.900000, r4=4.400000, &end
# Atom 1: H LEU 36, Atom 2: HB3 LEU 36
 &rst iat=548, 553, r3=3.900000, r4=4.400000, &end
# Atom 1: H LEU 36, Atom 2: HG LEU 36
 &rst iat=548, 555, r3=5.100000, r4=5.600000, &end
# Atom 1: H LEU 36, Atom 2: QQD LEU 36
 &rst iat=548, -1, r3=6.770000, r4=7.270000, igr2=557, 558, 559, 561, 562, 563, &end
# Atom 1: H LEU 36, Atom 2: H VAL 37
 &rst iat=548, 567, r3=4.900000, r4=5.400000, &end
# Atom 1: H LEU 36, Atom 2: HA VAL 37
 &rst iat=548, 569, r3=5.300000, r4=5.800000, &end
# Atom 1: H LEU 36, Atom 2: HA ALA 44
 &rst iat=548, 672, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 36, Atom 2: H GLU 45
 &rst iat=548, 680, r3=5.000000, r4=5.500000, &end
# Atom 1: H LEU 36, Atom 2: HA GLU 45
 &rst iat=548, 682, r3=5.300000, r4=5.800000, &end
# Atom 1: H LEU 36, Atom 2: QB GLU 45
 &rst iat=548, -1, r3=7.000000, r4=7.500000, igr2=684, 685, &end
# Atom 1: H LEU 36, Atom 2: H ILE 46
 &rst iat=548, 695, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 36, Atom 2: HA ILE 46
 &rst iat=548, 697, r3=5.500000, r4=6.000000, &end
# Atom 1: H LEU 36, Atom 2: HB ILE 46
 &rst iat=548, 699, r3=5.500000, r4=6.000000, &end
# Atom 1: H LEU 36, Atom 2: HG12 ILE 46
 &rst iat=548, 705, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 36, Atom 2: HG13 ILE 46
 &rst iat=548, 706, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 36, Atom 2: QD ILE 46
 &rst iat=548, -1, r3=6.600000, r4=7.100000, igr2=708, 709, 710, &end
# Atom 1: H LEU 36, Atom 2: H LYS 47
 &rst iat=548, 714, r3=5.700000, r4=6.200000, &end
# Atom 1: HA LEU 36, Atom 2: H VAL 37
 &rst iat=550, 567, r3=3.200000, r4=3.700000, &end
# Atom 1: HA LEU 36, Atom 2: H GLU 45
 &rst iat=550, 680, r3=5.400000, r4=5.900000, &end
# Atom 1: HB2 LEU 36, Atom 2: H VAL 37
 &rst iat=552, 567, r3=4.700000, r4=5.200000, &end
# Atom 1: HB3 LEU 36, Atom 2: H VAL 37
 &rst iat=553, 567, r3=4.700000, r4=5.200000, &end
# Atom 1: QB LEU 36, Atom 2: H GLU 45
 &rst iat=-1, 680, r3=6.880000, r4=7.380000, igr1=552, 553, &end
# Atom 1: HG LEU 36, Atom 2: H VAL 37
 &rst iat=555, 567, r3=6.000000, r4=6.500000, &end
# Atom 1: HG LEU 36, Atom 2: H GLU 45
 &rst iat=555, 680, r3=6.000000, r4=6.500000, &end
# Atom 1: QQD LEU 36, Atom 2: H VAL 37
 &rst iat=-1, 567, r3=7.270000, r4=7.770000, igr1=557, 558, 559, 561, 562, 563, &end
# Atom 1: QQD LEU 36, Atom 2: H ALA 38
 &rst iat=-1, 583, r3=8.570000, r4=9.070000, igr1=557, 558, 559, 561, 562, 563, &end
# Atom 1: QQD LEU 36, Atom 2: H ALA 44
 &rst iat=-1, 670, r3=8.570000, r4=9.070000, igr1=557, 558, 559, 561, 562, 563, &end
# Atom 1: QQD LEU 36, Atom 2: H GLU 45
 &rst iat=-1, 680, r3=7.070000, r4=7.570000, igr1=557, 558, 559, 561, 562, 563, &end
# Atom 1: H VAL 37, Atom 2: HB VAL 37
 &rst iat=567, 571, r3=3.700000, r4=4.200000, &end
# Atom 1: H VAL 37, Atom 2: H ALA 38
 &rst iat=567, 583, r3=4.800000, r4=5.300000, &end
# Atom 1: H VAL 37, Atom 2: HA ALA 44
 &rst iat=567, 672, r3=6.000000, r4=6.500000, &end
# Atom 1: H VAL 37, Atom 2: QB ALA 44
 &rst iat=567, -1, r3=7.000000, r4=7.500000, igr2=674, 675, 676, &end
# Atom 1: H VAL 37, Atom 2: H GLU 45
 &rst iat=567, 680, r3=6.000000, r4=6.500000, &end
# Atom 1: HA VAL 37, Atom 2: H ALA 38
 &rst iat=569, 583, r3=3.500000, r4=4.000000, &end
# Atom 1: HA VAL 37, Atom 2: H LYS 43
 &rst iat=569, 648, r3=5.700000, r4=6.200000, &end
# Atom 1: HA VAL 37, Atom 2: H ALA 44
 &rst iat=569, 670, r3=6.000000, r4=6.500000, &end
# Atom 1: HA VAL 37, Atom 2: H GLU 45
 &rst iat=569, 680, r3=5.200000, r4=5.700000, &end
# Atom 1: HB VAL 37, Atom 2: H ALA 38
 &rst iat=571, 583, r3=5.000000, r4=5.500000, &end
# Atom 1: HB VAL 37, Atom 2: H LYS 43
 &rst iat=571, 648, r3=6.000000, r4=6.500000, &end
# Atom 1: QG1 VAL 37, Atom 2: H ALA 38
 &rst iat=-1, 583, r3=6.000000, r4=6.500000, igr1=573, 574, 575, &end
# Atom 1: QG1 VAL 37, Atom 2: H LYS 43
 &rst iat=-1, 648, r3=6.300000, r4=6.800000, igr1=573, 574, 575, &end
# Atom 1: QG1 VAL 37, Atom 2: H GLU 45
 &rst iat=-1, 680, r3=7.000000, r4=7.500000, igr1=573, 574, 575, &end
# Atom 1: QG2 VAL 37, Atom 2: H ALA 38
 &rst iat=-1, 583, r3=6.000000, r4=6.500000, igr1=577, 578, 579, &end
# Atom 1: QG2 VAL 37, Atom 2: H LYS 43
 &rst iat=-1, 648, r3=6.300000, r4=6.800000, igr1=577, 578, 579, &end
# Atom 1: QG2 VAL 37, Atom 2: H GLU 45
 &rst iat=-1, 680, r3=7.000000, r4=7.500000, igr1=577, 578, 579, &end
# Atom 1: QQG VAL 37, Atom 2: H LEU 39
 &rst iat=-1, 593, r3=8.560000, r4=9.060000, igr1=573, 574, 575, 577, 578, 579, &end
# Atom 1: QQG VAL 37, Atom 2: H LYS 43
 &rst iat=-1, 648, r3=5.750000, r4=6.250000, igr1=573, 574, 575, 577, 578, 579, &end
# Atom 1: QQG VAL 37, Atom 2: H GLU 45
 &rst iat=-1, 680, r3=6.570000, r4=7.070000, igr1=573, 574, 575, 577, 578, 579, &end
# Atom 1: H ALA 38, Atom 2: H LEU 39
 &rst iat=583, 593, r3=5.100000, r4=5.600000, &end
# Atom 1: H ALA 38, Atom 2: H GLY 42
 &rst iat=583, 641, r3=6.000000, r4=6.500000, &end
# Atom 1: H ALA 38, Atom 2: H LYS 43
 &rst iat=583, 648, r3=5.100000, r4=5.600000, &end
# Atom 1: H ALA 38, Atom 2: HB2 LYS 43
 &rst iat=583, 652, r3=6.000000, r4=6.500000, &end
# Atom 1: H ALA 38, Atom 2: HB3 LYS 43
 &rst iat=583, 653, r3=6.000000, r4=6.500000, &end
# Atom 1: H ALA 38, Atom 2: HG2 LYS 43
 &rst iat=583, 655, r3=5.900000, r4=6.400000, &end
# Atom 1: H ALA 38, Atom 2: HG3 LYS 43
 &rst iat=583, 656, r3=5.900000, r4=6.400000, &end
# Atom 1: H ALA 38, Atom 2: QG LYS 43
 &rst iat=583, -1, r3=5.540000, r4=6.040000, igr2=655, 656, &end
# Atom 1: H ALA 38, Atom 2: HA ALA 44
 &rst iat=583, 672, r3=5.100000, r4=5.600000, &end
# Atom 1: H ALA 38, Atom 2: QB ALA 44
 &rst iat=583, -1, r3=7.000000, r4=7.500000, igr2=674, 675, 676, &end
# Atom 1: HA ALA 38, Atom 2: H LEU 39
 &rst iat=585, 593, r3=3.600000, r4=4.100000, &end
# Atom 1: HA ALA 38, Atom 2: H MET 40
 &rst iat=585, 612, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ALA 38, Atom 2: H GLY 42
 &rst iat=585, 641, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ALA 38, Atom 2: H LYS 43
 &rst iat=585, 648, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 39, Atom 2: HB2 LEU 39
 &rst iat=593, 597, r3=4.000000, r4=4.500000, &end
# Atom 1: H LEU 39, Atom 2: HB3 LEU 39
 &rst iat=593, 598, r3=4.000000, r4=4.500000, &end
# Atom 1: H LEU 39, Atom 2: HG LEU 39
 &rst iat=593, 600, r3=3.900000, r4=4.400000, &end
# Atom 1: H LEU 39, Atom 2: QD1 LEU 39
 &rst iat=593, -1, r3=5.400000, r4=5.900000, igr2=602, 603, 604, &end
# Atom 1: H LEU 39, Atom 2: QD2 LEU 39
 &rst iat=593, -1, r3=5.400000, r4=5.900000, igr2=606, 607, 608, &end
# Atom 1: H LEU 39, Atom 2: QQD LEU 39
 &rst iat=593, -1, r3=5.010000, r4=5.510000, igr2=602, 603, 604, 606, 607, 608, &end
# Atom 1: H LEU 39, Atom 2: QB MET 40
 &rst iat=593, -1, r3=5.980000, r4=6.480000, igr2=616, 617, &end
# Atom 1: H LEU 39, Atom 2: H ALA 41
 &rst iat=593, 631, r3=5.800000, r4=6.300000, &end
# Atom 1: H LEU 39, Atom 2: H GLY 42
 &rst iat=593, 641, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 39, Atom 2: H LYS 43
 &rst iat=593, 648, r3=6.000000, r4=6.500000, &end
# Atom 1: HA LEU 39, Atom 2: H GLY 42
 &rst iat=595, 641, r3=5.400000, r4=5.900000, &end
# Atom 1: HA LEU 39, Atom 2: H LYS 43
 &rst iat=595, 648, r3=5.800000, r4=6.300000, &end
# Atom 1: QB LEU 39, Atom 2: H ALA 41
 &rst iat=-1, 631, r3=5.880000, r4=6.380000, igr1=597, 598, &end
# Atom 1: QD1 LEU 39, Atom 2: H MET 40
 &rst iat=-1, 612, r3=7.000000, r4=7.500000, igr1=602, 603, 604, &end
# Atom 1: QD2 LEU 39, Atom 2: H MET 40
 &rst iat=-1, 612, r3=7.000000, r4=7.500000, igr1=606, 607, 608, &end
# Atom 1: QQD LEU 39, Atom 2: H MET 40
 &rst iat=-1, 612, r3=6.620000, r4=7.120000, igr1=602, 603, 604, 606, 607, 608, &end
# Atom 1: QQD LEU 39, Atom 2: H ALA 41
 &rst iat=-1, 631, r3=8.570000, r4=9.070000, igr1=602, 603, 604, 606, 607, 608, &end
# Atom 1: QQD LEU 39, Atom 2: H GLY 42
 &rst iat=-1, 641, r3=8.570000, r4=9.070000, igr1=602, 603, 604, 606, 607, 608, &end
# Atom 1: H MET 40, Atom 2: H ALA 41
 &rst iat=612, 631, r3=5.200000, r4=5.700000, &end
# Atom 1: H MET 40, Atom 2: H GLY 42
 &rst iat=612, 641, r3=5.800000, r4=6.300000, &end
# Atom 1: H MET 40, Atom 2: H LYS 43
 &rst iat=612, 648, r3=5.300000, r4=5.800000, &end
# Atom 1: H MET 40, Atom 2: QG LYS 43
 &rst iat=612, -1, r3=6.880000, r4=7.380000, igr2=655, 656, &end
# Atom 1: HA MET 40, Atom 2: H GLY 42
 &rst iat=614, 641, r3=5.500000, r4=6.000000, &end
# Atom 1: HB2 MET 40, Atom 2: H ALA 41
 &rst iat=616, 631, r3=4.100000, r4=4.600000, &end
# Atom 1: HB3 MET 40, Atom 2: H ALA 41
 &rst iat=617, 631, r3=4.100000, r4=4.600000, &end
# Atom 1: QB MET 40, Atom 2: H ALA 41
 &rst iat=-1, 631, r3=3.850000, r4=4.350000, igr1=616, 617, &end
# Atom 1: QB MET 40, Atom 2: H GLY 42
 &rst iat=-1, 641, r3=6.780000, r4=7.280000, igr1=616, 617, &end
# Atom 1: H ALA 41, Atom 2: H GLY 42
 &rst iat=631, 641, r3=3.900000, r4=4.400000, &end
# Atom 1: QB ALA 41, Atom 2: H LYS 43
 &rst iat=-1, 648, r3=4.900000, r4=5.400000, igr1=635, 636, 637, &end
# Atom 1: H GLY 42, Atom 2: H LYS 43
 &rst iat=641, 648, r3=3.600000, r4=4.100000, &end
# Atom 1: H GLY 42, Atom 2: HA LYS 43
 &rst iat=641, 650, r3=5.800000, r4=6.300000, &end
# Atom 1: H GLY 42, Atom 2: QB LYS 43
 &rst iat=641, -1, r3=6.180000, r4=6.680000, igr2=652, 653, &end
# Atom 1: H GLY 42, Atom 2: QD LYS 43
 &rst iat=641, -1, r3=7.000000, r4=7.500000, igr2=658, 659, &end
# Atom 1: H LYS 43, Atom 2: HB2 LYS 43
 &rst iat=648, 652, r3=3.600000, r4=4.100000, &end
# Atom 1: H LYS 43, Atom 2: HB3 LYS 43
 &rst iat=648, 653, r3=3.600000, r4=4.100000, &end
# Atom 1: H LYS 43, Atom 2: HG2 LYS 43
 &rst iat=648, 655, r3=3.300000, r4=3.800000, &end
# Atom 1: H LYS 43, Atom 2: HG3 LYS 43
 &rst iat=648, 656, r3=3.300000, r4=3.800000, &end
# Atom 1: H LYS 43, Atom 2: QD LYS 43
 &rst iat=648, -1, r3=6.500000, r4=7.000000, igr2=658, 659, &end
# Atom 1: H LYS 43, Atom 2: QE LYS 43
 &rst iat=648, -1, r3=7.000000, r4=7.500000, igr2=661, 662, &end
# Atom 1: H LYS 43, Atom 2: H ALA 44
 &rst iat=648, 670, r3=4.600000, r4=5.100000, &end
# Atom 1: H LYS 43, Atom 2: HA ALA 44
 &rst iat=648, 672, r3=5.100000, r4=5.600000, &end
# Atom 1: H LYS 43, Atom 2: QB ALA 44
 &rst iat=648, -1, r3=6.500000, r4=7.000000, igr2=674, 675, 676, &end
# Atom 1: HA LYS 43, Atom 2: H ALA 44
 &rst iat=650, 670, r3=3.300000, r4=3.800000, &end
# Atom 1: HB2 LYS 43, Atom 2: H ALA 44
 &rst iat=652, 670, r3=4.000000, r4=4.500000, &end
# Atom 1: HB3 LYS 43, Atom 2: H ALA 44
 &rst iat=653, 670, r3=4.000000, r4=4.500000, &end
# Atom 1: QG LYS 43, Atom 2: H ALA 44
 &rst iat=-1, 670, r3=5.980000, r4=6.480000, igr1=655, 656, &end
# Atom 1: H ALA 44, Atom 2: H GLU 45
 &rst iat=670, 680, r3=5.300000, r4=5.800000, &end
# Atom 1: H ALA 44, Atom 2: HA GLU 45
 &rst iat=670, 682, r3=5.600000, r4=6.100000, &end
# Atom 1: HA ALA 44, Atom 2: H GLU 45
 &rst iat=672, 680, r3=3.400000, r4=3.900000, &end
# Atom 1: H GLU 45, Atom 2: QG GLU 45
 &rst iat=680, -1, r3=5.600000, r4=6.100000, igr2=687, 688, &end
# Atom 1: H GLU 45, Atom 2: H ILE 46
 &rst iat=680, 695, r3=4.800000, r4=5.300000, &end
# Atom 1: HA GLU 45, Atom 2: H ILE 46
 &rst iat=682, 695, r3=3.500000, r4=4.000000, &end
# Atom 1: QG GLU 45, Atom 2: H ILE 46
 &rst iat=-1, 695, r3=7.000000, r4=7.500000, igr1=687, 688, &end
# Atom 1: H ILE 46, Atom 2: HB ILE 46
 &rst iat=695, 699, r3=3.800000, r4=4.300000, &end
# Atom 1: H ILE 46, Atom 2: HG12 ILE 46
 &rst iat=695, 705, r3=4.400000, r4=4.900000, &end
# Atom 1: H ILE 46, Atom 2: HG13 ILE 46
 &rst iat=695, 706, r3=4.400000, r4=4.900000, &end
# Atom 1: H ILE 46, Atom 2: QD ILE 46
 &rst iat=695, -1, r3=5.200000, r4=5.700000, igr2=708, 709, 710, &end
# Atom 1: H ILE 46, Atom 2: H LYS 47
 &rst iat=695, 714, r3=4.600000, r4=5.100000, &end
# Atom 1: H ILE 46, Atom 2: QD TYR 48
 &rst iat=695, -1, r3=8.000000, r4=8.500000, igr2=744, 753, &end
# Atom 1: H ILE 46, Atom 2: QD ILE 58
 &rst iat=695, -1, r3=7.000000, r4=7.500000, igr2=911, 912, 913, &end
# Atom 1: HA ILE 46, Atom 2: H LYS 47
 &rst iat=697, 714, r3=3.500000, r4=4.000000, &end
# Atom 1: HA ILE 46, Atom 2: H TYR 48
 &rst iat=697, 736, r3=6.000000, r4=6.500000, &end
# Atom 1: HB ILE 46, Atom 2: H LYS 47
 &rst iat=699, 714, r3=4.800000, r4=5.300000, &end
# Atom 1: HB ILE 46, Atom 2: H TYR 48
 &rst iat=699, 736, r3=5.600000, r4=6.100000, &end
# Atom 1: QG2 ILE 46, Atom 2: H LYS 47
 &rst iat=-1, 714, r3=5.700000, r4=6.200000, igr1=701, 702, 703, &end
# Atom 1: QG2 ILE 46, Atom 2: H TYR 48
 &rst iat=-1, 736, r3=7.000000, r4=7.500000, igr1=701, 702, 703, &end
# Atom 1: QG1 ILE 46, Atom 2: H LYS 47
 &rst iat=-1, 714, r3=6.880000, r4=7.380000, igr1=705, 706, &end
# Atom 1: QD ILE 46, Atom 2: H LYS 47
 &rst iat=-1, 714, r3=6.200000, r4=6.700000, igr1=708, 709, 710, &end
# Atom 1: QD ILE 46, Atom 2: H TYR 48
 &rst iat=-1, 736, r3=7.000000, r4=7.500000, igr1=708, 709, 710, &end
# Atom 1: H LYS 47, Atom 2: HB2 LYS 47
 &rst iat=714, 718, r3=4.000000, r4=4.500000, &end
# Atom 1: H LYS 47, Atom 2: HB3 LYS 47
 &rst iat=714, 719, r3=4.000000, r4=4.500000, &end
# Atom 1: H LYS 47, Atom 2: HG2 LYS 47
 &rst iat=714, 721, r3=4.900000, r4=5.400000, &end
# Atom 1: H LYS 47, Atom 2: HG3 LYS 47
 &rst iat=714, 722, r3=4.900000, r4=5.400000, &end
# Atom 1: H LYS 47, Atom 2: QG LYS 47
 &rst iat=714, -1, r3=4.430000, r4=4.930000, igr2=721, 722, &end
# Atom 1: H LYS 47, Atom 2: QD LYS 47
 &rst iat=714, -1, r3=6.000000, r4=6.500000, igr2=724, 725, &end
# Atom 1: H LYS 47, Atom 2: QE LYS 47
 &rst iat=714, -1, r3=7.000000, r4=7.500000, igr2=727, 728, &end
# Atom 1: H LYS 47, Atom 2: H TYR 48
 &rst iat=714, 736, r3=5.100000, r4=5.600000, &end
# Atom 1: H LYS 47, Atom 2: QB TYR 48
 &rst iat=714, -1, r3=6.880000, r4=7.380000, igr2=740, 741, &end
# Atom 1: H LYS 47, Atom 2: QD TYR 48
 &rst iat=714, -1, r3=8.000000, r4=8.500000, igr2=744, 753, &end
# Atom 1: H LYS 47, Atom 2: QD ILE 58
 &rst iat=714, -1, r3=7.000000, r4=7.500000, igr2=911, 912, 913, &end
# Atom 1: HA LYS 47, Atom 2: H TYR 48
 &rst iat=716, 736, r3=3.600000, r4=4.100000, &end
# Atom 1: HB2 LYS 47, Atom 2: H TYR 48
 &rst iat=718, 736, r3=4.800000, r4=5.300000, &end
# Atom 1: HB3 LYS 47, Atom 2: H TYR 48
 &rst iat=719, 736, r3=4.800000, r4=5.300000, &end
# Atom 1: HG2 LYS 47, Atom 2: H TYR 48
 &rst iat=721, 736, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 LYS 47, Atom 2: H TYR 48
 &rst iat=722, 736, r3=6.000000, r4=6.500000, &end
# Atom 1: QD LYS 47, Atom 2: H TYR 48
 &rst iat=-1, 736, r3=7.000000, r4=7.500000, igr1=724, 725, &end
# Atom 1: H TYR 48, Atom 2: QE TYR 48
 &rst iat=736, -1, r3=7.000000, r4=7.500000, igr2=746, 751, &end
# Atom 1: H TYR 48, Atom 2: H ASP 49
 &rst iat=736, 757, r3=4.800000, r4=5.300000, &end
# Atom 1: H TYR 48, Atom 2: QD ILE 53
 &rst iat=736, -1, r3=5.800000, r4=6.300000, igr2=827, 828, 829, &end
# Atom 1: H TYR 48, Atom 2: QD ILE 58
 &rst iat=736, -1, r3=7.000000, r4=7.500000, igr2=911, 912, 913, &end
# Atom 1: QB TYR 48, Atom 2: H ILE 53
 &rst iat=-1, 814, r3=6.880000, r4=7.380000, igr1=740, 741, &end
# Atom 1: QD TYR 48, Atom 2: H ASP 49
 &rst iat=-1, 757, r3=8.000000, r4=8.500000, igr1=744, 753, &end
# Atom 1: QD TYR 48, Atom 2: H ILE 53
 &rst iat=-1, 814, r3=8.000000, r4=8.500000, igr1=744, 753, &end
# Atom 1: QE TYR 48, Atom 2: H ILE 53
 &rst iat=-1, 814, r3=8.000000, r4=8.500000, igr1=746, 751, &end
# Atom 1: QE TYR 48, Atom 2: HNE1 GLN 54
 &rst iat=-1, 845, r3=8.000000, r4=8.500000, igr1=746, 751, &end
# Atom 1: QE TYR 48, Atom 2: HNE2 GLN 54
 &rst iat=-1, 846, r3=8.000000, r4=8.500000, igr1=746, 751, &end
# Atom 1: H ASP 49, Atom 2: HB2 ASP 49
 &rst iat=757, 761, r3=3.900000, r4=4.400000, &end
# Atom 1: H ASP 49, Atom 2: HB3 ASP 49
 &rst iat=757, 762, r3=3.900000, r4=4.400000, &end
# Atom 1: H ASP 49, Atom 2: QB ASP 49
 &rst iat=757, -1, r3=3.700000, r4=4.200000, igr2=761, 762, &end
# Atom 1: H ASP 49, Atom 2: HD2 PRO 50
 &rst iat=757, 770, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASP 49, Atom 2: HD3 PRO 50
 &rst iat=757, 771, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASP 49, Atom 2: H GLU 51
 &rst iat=757, 783, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASP 49, Atom 2: QQG VAL 52
 &rst iat=757, -1, r3=8.400000, r4=8.900000, igr2=804, 805, 806, 808, 809, 810, &end
# Atom 1: H ASP 49, Atom 2: H ILE 53
 &rst iat=757, 814, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASP 49, Atom 2: QD ILE 53
 &rst iat=757, -1, r3=5.700000, r4=6.200000, igr2=827, 828, 829, &end
# Atom 1: H ASP 49, Atom 2: QD ILE 58
 &rst iat=757, -1, r3=7.000000, r4=7.500000, igr2=911, 912, 913, &end
# Atom 1: HA ASP 49, Atom 2: H GLU 51
 &rst iat=759, 783, r3=5.500000, r4=6.000000, &end
# Atom 1: HB2 ASP 49, Atom 2: H GLU 51
 &rst iat=761, 783, r3=5.800000, r4=6.300000, &end
# Atom 1: HB2 ASP 49, Atom 2: H VAL 52
 &rst iat=761, 798, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 ASP 49, Atom 2: H GLU 51
 &rst iat=762, 783, r3=5.800000, r4=6.300000, &end
# Atom 1: HB3 ASP 49, Atom 2: H VAL 52
 &rst iat=762, 798, r3=6.000000, r4=6.500000, &end
# Atom 1: QB ASP 49, Atom 2: H GLU 51
 &rst iat=-1, 783, r3=5.530000, r4=6.030000, igr1=761, 762, &end
# Atom 1: QB ASP 49, Atom 2: H VAL 52
 &rst iat=-1, 798, r3=5.590000, r4=6.090000, igr1=761, 762, &end
# Atom 1: QB ASP 49, Atom 2: H ILE 53
 &rst iat=-1, 814, r3=6.780000, r4=7.280000, igr1=761, 762, &end
# Atom 1: HA PRO 50, Atom 2: H VAL 52
 &rst iat=779, 798, r3=5.800000, r4=6.300000, &end
# Atom 1: HA PRO 50, Atom 2: H ILE 53
 &rst iat=779, 814, r3=4.900000, r4=5.400000, &end
# Atom 1: HA PRO 50, Atom 2: HNE1 GLN 54
 &rst iat=779, 845, r3=6.000000, r4=6.500000, &end
# Atom 1: HA PRO 50, Atom 2: HNE2 GLN 54
 &rst iat=779, 846, r3=6.000000, r4=6.500000, &end
# Atom 1: HA PRO 50, Atom 2: QNE GLN 54
 &rst iat=779, -1, r3=5.450000, r4=5.950000, igr2=845, 846, &end
# Atom 1: HB2 PRO 50, Atom 2: H GLU 51
 &rst iat=776, 783, r3=4.700000, r4=5.200000, &end
# Atom 1: HB3 PRO 50, Atom 2: H GLU 51
 &rst iat=777, 783, r3=4.700000, r4=5.200000, &end
# Atom 1: QG PRO 50, Atom 2: H GLU 51
 &rst iat=-1, 783, r3=5.420000, r4=5.920000, igr1=773, 774, &end
# Atom 1: QD PRO 50, Atom 2: H VAL 52
 &rst iat=-1, 798, r3=6.880000, r4=7.380000, igr1=770, 771, &end
# Atom 1: H GLU 51, Atom 2: HB2 GLU 51
 &rst iat=783, 787, r3=4.100000, r4=4.600000, &end
# Atom 1: H GLU 51, Atom 2: HB3 GLU 51
 &rst iat=783, 788, r3=4.100000, r4=4.600000, &end
# Atom 1: H GLU 51, Atom 2: QB GLU 51
 &rst iat=783, -1, r3=3.760000, r4=4.260000, igr2=787, 788, &end
# Atom 1: H GLU 51, Atom 2: HG2 GLU 51
 &rst iat=783, 790, r3=4.800000, r4=5.300000, &end
# Atom 1: H GLU 51, Atom 2: HG3 GLU 51
 &rst iat=783, 791, r3=4.800000, r4=5.300000, &end
# Atom 1: H GLU 51, Atom 2: QG GLU 51
 &rst iat=783, -1, r3=4.520000, r4=5.020000, igr2=790, 791, &end
# Atom 1: H GLU 51, Atom 2: H VAL 52
 &rst iat=783, 798, r3=3.300000, r4=3.800000, &end
# Atom 1: H GLU 51, Atom 2: HA VAL 52
 &rst iat=783, 800, r3=5.500000, r4=6.000000, &end
# Atom 1: H GLU 51, Atom 2: QQG VAL 52
 &rst iat=783, -1, r3=8.100000, r4=8.600000, igr2=804, 805, 806, 808, 809, 810, &end
# Atom 1: HA GLU 51, Atom 2: HNE1 GLN 54
 &rst iat=785, 845, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLU 51, Atom 2: HNE2 GLN 54
 &rst iat=785, 846, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 GLU 51, Atom 2: H VAL 52
 &rst iat=790, 798, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 GLU 51, Atom 2: H ILE 53
 &rst iat=790, 814, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLU 51, Atom 2: H VAL 52
 &rst iat=791, 798, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLU 51, Atom 2: H ILE 53
 &rst iat=791, 814, r3=6.000000, r4=6.500000, &end
# Atom 1: QG GLU 51, Atom 2: H ILE 53
 &rst iat=-1, 814, r3=5.790000, r4=6.290000, igr1=790, 791, &end
# Atom 1: H VAL 52, Atom 2: HB VAL 52
 &rst iat=798, 802, r3=4.100000, r4=4.600000, &end
# Atom 1: H VAL 52, Atom 2: H ILE 53
 &rst iat=798, 814, r3=3.200000, r4=3.700000, &end
# Atom 1: H VAL 52, Atom 2: HA ILE 53
 &rst iat=798, 816, r3=5.800000, r4=6.300000, &end
# Atom 1: H VAL 52, Atom 2: HB ILE 53
 &rst iat=798, 818, r3=5.500000, r4=6.000000, &end
# Atom 1: H VAL 52, Atom 2: H GLN 54
 &rst iat=798, 833, r3=6.000000, r4=6.500000, &end
# Atom 1: HB VAL 52, Atom 2: H ILE 53
 &rst iat=802, 814, r3=4.000000, r4=4.500000, &end
# Atom 1: QQG VAL 52, Atom 2: H ILE 53
 &rst iat=-1, 814, r3=6.600000, r4=7.100000, igr1=804, 805, 806, 808, 809, 810, &end
# Atom 1: H ILE 53, Atom 2: HB ILE 53
 &rst iat=814, 818, r3=4.000000, r4=4.500000, &end
# Atom 1: H ILE 53, Atom 2: QG1 ILE 53
 &rst iat=814, -1, r3=6.500000, r4=7.000000, igr2=824, 825, &end
# Atom 1: H ILE 53, Atom 2: QD ILE 53
 &rst iat=814, -1, r3=5.100000, r4=5.600000, igr2=827, 828, 829, &end
# Atom 1: H ILE 53, Atom 2: H GLN 54
 &rst iat=814, 833, r3=5.200000, r4=5.700000, &end
# Atom 1: H ILE 53, Atom 2: QNE GLN 54
 &rst iat=814, -1, r3=6.870000, r4=7.370000, igr2=845, 846, &end
# Atom 1: HA ILE 53, Atom 2: H GLN 54
 &rst iat=816, 833, r3=3.500000, r4=4.000000, &end
# Atom 1: QG1 ILE 53, Atom 2: H GLN 54
 &rst iat=-1, 833, r3=7.000000, r4=7.500000, igr1=824, 825, &end
# Atom 1: QG1 ILE 53, Atom 2: H ILE 58
 &rst iat=-1, 898, r3=5.500000, r4=6.000000, igr1=824, 825, &end
# Atom 1: QD ILE 53, Atom 2: H GLN 54
 &rst iat=-1, 833, r3=6.600000, r4=7.100000, igr1=827, 828, 829, &end
# Atom 1: QD ILE 53, Atom 2: HNE1 GLN 54
 &rst iat=-1, 845, r3=7.000000, r4=7.500000, igr1=827, 828, 829, &end
# Atom 1: QD ILE 53, Atom 2: HNE2 GLN 54
 &rst iat=-1, 846, r3=7.000000, r4=7.500000, igr1=827, 828, 829, &end
# Atom 1: QD ILE 53, Atom 2: H GLU 57
 &rst iat=-1, 883, r3=6.600000, r4=7.100000, igr1=827, 828, 829, &end
# Atom 1: QD ILE 53, Atom 2: H ILE 58
 &rst iat=-1, 898, r3=6.600000, r4=7.100000, igr1=827, 828, 829, &end
# Atom 1: H GLN 54, Atom 2: HB2 GLN 54
 &rst iat=833, 837, r3=4.000000, r4=4.500000, &end
# Atom 1: H GLN 54, Atom 2: HB3 GLN 54
 &rst iat=833, 838, r3=4.000000, r4=4.500000, &end
# Atom 1: H GLN 54, Atom 2: QB GLN 54
 &rst iat=833, -1, r3=3.610000, r4=4.110000, igr2=837, 838, &end
# Atom 1: H GLN 54, Atom 2: QG GLN 54
 &rst iat=833, -1, r3=5.500000, r4=6.000000, igr2=840, 841, &end
# Atom 1: H GLN 54, Atom 2: QG PRO 55
 &rst iat=833, -1, r3=6.880000, r4=7.380000, igr2=854, 855, &end
# Atom 1: H GLN 54, Atom 2: QD PRO 55
 &rst iat=833, -1, r3=6.880000, r4=7.380000, igr2=851, 852, &end
# Atom 1: H GLN 54, Atom 2: H LEU 56
 &rst iat=833, 864, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLN 54, Atom 2: QQD LEU 56
 &rst iat=833, -1, r3=8.570000, r4=9.070000, igr2=873, 874, 875, 877, 878, 879, &end
# Atom 1: H GLN 54, Atom 2: H GLU 57
 &rst iat=833, 883, r3=5.100000, r4=5.600000, &end
# Atom 1: H GLN 54, Atom 2: QG GLU 57
 &rst iat=833, -1, r3=6.880000, r4=7.380000, igr2=890, 891, &end
# Atom 1: H GLN 54, Atom 2: H ILE 58
 &rst iat=833, 898, r3=5.600000, r4=6.100000, &end
# Atom 1: H GLN 54, Atom 2: HB ILE 58
 &rst iat=833, 902, r3=5.100000, r4=5.600000, &end
# Atom 1: H GLN 54, Atom 2: QG1 ILE 58
 &rst iat=833, -1, r3=6.880000, r4=7.380000, igr2=908, 909, &end
# Atom 1: H GLN 54, Atom 2: QD ILE 58
 &rst iat=833, -1, r3=7.000000, r4=7.500000, igr2=911, 912, 913, &end
# Atom 1: HA GLN 54, Atom 2: HNE1 GLN 54
 &rst iat=835, 845, r3=5.800000, r4=6.300000, &end
# Atom 1: HA GLN 54, Atom 2: HNE2 GLN 54
 &rst iat=835, 846, r3=5.800000, r4=6.300000, &end
# Atom 1: HA GLN 54, Atom 2: H LEU 56
 &rst iat=835, 864, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 GLN 54, Atom 2: HNE1 GLN 54
 &rst iat=837, 845, r3=7.250000, r4=7.750000, &end
# Atom 1: HB2 GLN 54, Atom 2: HNE2 GLN 54
 &rst iat=837, 846, r3=7.250000, r4=7.750000, &end
# Atom 1: HB2 GLN 54, Atom 2: H LEU 56
 &rst iat=837, 864, r3=5.000000, r4=5.500000, &end
# Atom 1: HB3 GLN 54, Atom 2: HNE1 GLN 54
 &rst iat=838, 845, r3=7.250000, r4=7.750000, &end
# Atom 1: HB3 GLN 54, Atom 2: HNE2 GLN 54
 &rst iat=838, 846, r3=7.250000, r4=7.750000, &end
# Atom 1: HB3 GLN 54, Atom 2: H LEU 56
 &rst iat=838, 864, r3=5.000000, r4=5.500000, &end
# Atom 1: QB GLN 54, Atom 2: H LEU 56
 &rst iat=-1, 864, r3=4.770000, r4=5.270000, igr1=837, 838, &end
# Atom 1: QB GLN 54, Atom 2: H ILE 58
 &rst iat=-1, 898, r3=5.980000, r4=6.480000, igr1=837, 838, &end
# Atom 1: HNE1 GLN 54, Atom 2: HB2 PRO 55
 &rst iat=845, 857, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE1 GLN 54, Atom 2: HB3 PRO 55
 &rst iat=845, 858, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE1 GLN 54, Atom 2: HG2 PRO 55
 &rst iat=845, 854, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE1 GLN 54, Atom 2: HG3 PRO 55
 &rst iat=845, 855, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE1 GLN 54, Atom 2: HD2 PRO 55
 &rst iat=845, 851, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE1 GLN 54, Atom 2: HD3 PRO 55
 &rst iat=845, 852, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE1 GLN 54, Atom 2: QD1 LEU 56
 &rst iat=845, -1, r3=10.140000, r4=10.640000, igr2=873, 874, 875, &end
# Atom 1: HNE1 GLN 54, Atom 2: QD2 LEU 56
 &rst iat=845, -1, r3=10.140000, r4=10.640000, igr2=877, 878, 879, &end
# Atom 1: HNE1 GLN 54, Atom 2: HG2 GLU 57
 &rst iat=845, 890, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE1 GLN 54, Atom 2: HG3 GLU 57
 &rst iat=845, 891, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE2 GLN 54, Atom 2: HB2 PRO 55
 &rst iat=846, 857, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE2 GLN 54, Atom 2: HB3 PRO 55
 &rst iat=846, 858, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE2 GLN 54, Atom 2: HG2 PRO 55
 &rst iat=846, 854, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE2 GLN 54, Atom 2: HG3 PRO 55
 &rst iat=846, 855, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE2 GLN 54, Atom 2: HD2 PRO 55
 &rst iat=846, 851, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE2 GLN 54, Atom 2: HD3 PRO 55
 &rst iat=846, 852, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE2 GLN 54, Atom 2: QD1 LEU 56
 &rst iat=846, -1, r3=10.140000, r4=10.640000, igr2=873, 874, 875, &end
# Atom 1: HNE2 GLN 54, Atom 2: QD2 LEU 56
 &rst iat=846, -1, r3=10.140000, r4=10.640000, igr2=877, 878, 879, &end
# Atom 1: HNE2 GLN 54, Atom 2: HG2 GLU 57
 &rst iat=846, 890, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE2 GLN 54, Atom 2: HG3 GLU 57
 &rst iat=846, 891, r3=7.750000, r4=8.250000, &end
# Atom 1: QNE GLN 54, Atom 2: QB PRO 55
 &rst iat=-1, -1, r3=6.820000, r4=7.320000, 
 igr1=845, 846, igr2=857, 858, &end
# Atom 1: QNE GLN 54, Atom 2: QG PRO 55
 &rst iat=-1, -1, r3=6.820000, r4=7.320000, 
 igr1=845, 846, igr2=854, 855, &end
# Atom 1: QNE GLN 54, Atom 2: QQD LEU 56
 &rst iat=-1, -1, r3=8.530000, r4=9.030000, 
 igr1=845, 846, igr2=873, 874, 875, 877, 878, 879, &end
# Atom 1: QNE GLN 54, Atom 2: QG GLU 57
 &rst iat=-1, -1, r3=6.820000, r4=7.320000, 
 igr1=845, 846, igr2=890, 891, &end
# Atom 1: QNE GLN 54, Atom 2: QE TYR 110
 &rst iat=-1, -1, r3=8.870000, r4=9.370000, 
 igr1=845, 846, igr2=1673, 1678, &end
# Atom 1: HA PRO 55, Atom 2: H ALA 59
 &rst iat=860, 917, r3=5.000000, r4=5.500000, &end
# Atom 1: H LEU 56, Atom 2: HG LEU 56
 &rst iat=864, 871, r3=4.300000, r4=4.800000, &end
# Atom 1: H LEU 56, Atom 2: QD1 LEU 56
 &rst iat=864, -1, r3=5.400000, r4=5.900000, igr2=873, 874, 875, &end
# Atom 1: H LEU 56, Atom 2: QD2 LEU 56
 &rst iat=864, -1, r3=5.400000, r4=5.900000, igr2=877, 878, 879, &end
# Atom 1: H LEU 56, Atom 2: QQD LEU 56
 &rst iat=864, -1, r3=4.910000, r4=5.410000, igr2=873, 874, 875, 877, 878, 879, &end
# Atom 1: H LEU 56, Atom 2: H GLU 57
 &rst iat=864, 883, r3=3.700000, r4=4.200000, &end
# Atom 1: H LEU 56, Atom 2: H ILE 58
 &rst iat=864, 898, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 56, Atom 2: QD ILE 58
 &rst iat=864, -1, r3=7.000000, r4=7.500000, igr2=911, 912, 913, &end
# Atom 1: H LEU 56, Atom 2: H ALA 59
 &rst iat=864, 917, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 56, Atom 2: QB ALA 59
 &rst iat=864, -1, r3=7.000000, r4=7.500000, igr2=921, 922, 923, &end
# Atom 1: HA LEU 56, Atom 2: H ALA 59
 &rst iat=866, 917, r3=4.500000, r4=5.000000, &end
# Atom 1: HB2 LEU 56, Atom 2: H GLU 57
 &rst iat=868, 883, r3=4.100000, r4=4.600000, &end
# Atom 1: HB2 LEU 56, Atom 2: H ALA 59
 &rst iat=868, 917, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 LEU 56, Atom 2: H GLU 57
 &rst iat=869, 883, r3=4.100000, r4=4.600000, &end
# Atom 1: HB3 LEU 56, Atom 2: H ALA 59
 &rst iat=869, 917, r3=6.000000, r4=6.500000, &end
# Atom 1: QB LEU 56, Atom 2: H GLU 57
 &rst iat=-1, 883, r3=3.810000, r4=4.310000, igr1=868, 869, &end
# Atom 1: QB LEU 56, Atom 2: H ILE 58
 &rst iat=-1, 898, r3=6.080000, r4=6.580000, igr1=868, 869, &end
# Atom 1: QB LEU 56, Atom 2: H ALA 59
 &rst iat=-1, 917, r3=5.450000, r4=5.950000, igr1=868, 869, &end
# Atom 1: QB LEU 56, Atom 2: H GLN 60
 &rst iat=-1, 927, r3=6.880000, r4=7.380000, igr1=868, 869, &end
# Atom 1: QB LEU 56, Atom 2: QNE GLN 60
 &rst iat=-1, -1, r3=7.740000, r4=8.240000, 
 igr1=868, 869, igr2=939, 940, &end
# Atom 1: HG LEU 56, Atom 2: H ALA 59
 &rst iat=871, 917, r3=6.000000, r4=6.500000, &end
# Atom 1: HG LEU 56, Atom 2: QNE GLN 60
 &rst iat=871, -1, r3=6.870000, r4=7.370000, igr2=939, 940, &end
# Atom 1: QD1 LEU 56, Atom 2: HNE1 GLN 60
 &rst iat=-1, 939, r3=9.640000, r4=10.140000, igr1=873, 874, 875, &end
# Atom 1: QD1 LEU 56, Atom 2: HNE2 GLN 60
 &rst iat=-1, 940, r3=9.640000, r4=10.140000, igr1=873, 874, 875, &end
# Atom 1: QD2 LEU 56, Atom 2: HNE1 GLN 60
 &rst iat=-1, 939, r3=9.640000, r4=10.140000, igr1=877, 878, 879, &end
# Atom 1: QD2 LEU 56, Atom 2: HNE2 GLN 60
 &rst iat=-1, 940, r3=9.640000, r4=10.140000, igr1=877, 878, 879, &end
# Atom 1: QQD LEU 56, Atom 2: H GLU 57
 &rst iat=-1, 883, r3=8.270000, r4=8.770000, igr1=873, 874, 875, 877, 878, 879, &end
# Atom 1: QQD LEU 56, Atom 2: H ILE 58
 &rst iat=-1, 898, r3=8.570000, r4=9.070000, igr1=873, 874, 875, 877, 878, 879, &end
# Atom 1: QQD LEU 56, Atom 2: H ALA 59
 &rst iat=-1, 917, r3=8.570000, r4=9.070000, igr1=873, 874, 875, 877, 878, 879, &end
# Atom 1: QQD LEU 56, Atom 2: H GLN 60
 &rst iat=-1, 927, r3=8.570000, r4=9.070000, igr1=873, 874, 875, 877, 878, 879, &end
# Atom 1: QQD LEU 56, Atom 2: QNE GLN 60
 &rst iat=-1, -1, r3=7.970000, r4=8.470000, 
 igr1=873, 874, 875, 877, 878, 879, igr2=939, 940, &end
# Atom 1: H GLU 57, Atom 2: QB GLU 57
 &rst iat=883, -1, r3=3.810000, r4=4.310000, igr2=887, 888, &end
# Atom 1: H GLU 57, Atom 2: HG2 GLU 57
 &rst iat=883, 890, r3=4.300000, r4=4.800000, &end
# Atom 1: H GLU 57, Atom 2: HG3 GLU 57
 &rst iat=883, 891, r3=4.300000, r4=4.800000, &end
# Atom 1: H GLU 57, Atom 2: QG GLU 57
 &rst iat=883, -1, r3=3.820000, r4=4.320000, igr2=890, 891, &end
# Atom 1: H GLU 57, Atom 2: HB ILE 58
 &rst iat=883, 902, r3=5.300000, r4=5.800000, &end
# Atom 1: H GLU 57, Atom 2: QG2 ILE 58
 &rst iat=883, -1, r3=7.000000, r4=7.500000, igr2=904, 905, 906, &end
# Atom 1: H GLU 57, Atom 2: QG1 ILE 58
 &rst iat=883, -1, r3=6.880000, r4=7.380000, igr2=908, 909, &end
# Atom 1: H GLU 57, Atom 2: H ALA 59
 &rst iat=883, 917, r3=5.200000, r4=5.700000, &end
# Atom 1: H GLU 57, Atom 2: H GLN 60
 &rst iat=883, 927, r3=5.300000, r4=5.800000, &end
# Atom 1: HA GLU 57, Atom 2: H ALA 59
 &rst iat=885, 917, r3=4.600000, r4=5.100000, &end
# Atom 1: HA GLU 57, Atom 2: H GLN 60
 &rst iat=885, 927, r3=4.300000, r4=4.800000, &end
# Atom 1: HA GLU 57, Atom 2: H PHE 61
 &rst iat=885, 944, r3=5.600000, r4=6.100000, &end
# Atom 1: QB GLU 57, Atom 2: H ALA 59
 &rst iat=-1, 917, r3=6.280000, r4=6.780000, igr1=887, 888, &end
# Atom 1: QB GLU 57, Atom 2: H GLN 60
 &rst iat=-1, 927, r3=6.880000, r4=7.380000, igr1=887, 888, &end
# Atom 1: H ILE 58, Atom 2: HB ILE 58
 &rst iat=898, 902, r3=3.200000, r4=3.700000, &end
# Atom 1: H ILE 58, Atom 2: HG12 ILE 58
 &rst iat=898, 908, r3=4.700000, r4=5.200000, &end
# Atom 1: H ILE 58, Atom 2: HG13 ILE 58
 &rst iat=898, 909, r3=4.700000, r4=5.200000, &end
# Atom 1: H ILE 58, Atom 2: QG1 ILE 58
 &rst iat=898, -1, r3=4.140000, r4=4.640000, igr2=908, 909, &end
# Atom 1: H ILE 58, Atom 2: QD ILE 58
 &rst iat=898, -1, r3=5.700000, r4=6.200000, igr2=911, 912, 913, &end
# Atom 1: H ILE 58, Atom 2: H ALA 59
 &rst iat=898, 917, r3=3.000000, r4=3.500000, &end
# Atom 1: H ILE 58, Atom 2: HA ALA 59
 &rst iat=898, 919, r3=5.100000, r4=5.600000, &end
# Atom 1: H ILE 58, Atom 2: QB ALA 59
 &rst iat=898, -1, r3=5.400000, r4=5.900000, igr2=921, 922, 923, &end
# Atom 1: H ILE 58, Atom 2: H GLN 60
 &rst iat=898, 927, r3=4.900000, r4=5.400000, &end
# Atom 1: H ILE 58, Atom 2: QB GLN 60
 &rst iat=898, -1, r3=6.180000, r4=6.680000, igr2=931, 932, &end
# Atom 1: H ILE 58, Atom 2: H PHE 61
 &rst iat=898, 944, r3=5.500000, r4=6.000000, &end
# Atom 1: H ILE 58, Atom 2: QD PHE 61
 &rst iat=898, -1, r3=7.500000, r4=8.000000, igr2=952, 960, &end
# Atom 1: HA ILE 58, Atom 2: H GLN 60
 &rst iat=900, 927, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ILE 58, Atom 2: H PHE 61
 &rst iat=900, 944, r3=5.100000, r4=5.600000, &end
# Atom 1: HA ILE 58, Atom 2: H ILE 62
 &rst iat=900, 964, r3=6.000000, r4=6.500000, &end
# Atom 1: HB ILE 58, Atom 2: H ALA 59
 &rst iat=902, 917, r3=3.600000, r4=4.100000, &end
# Atom 1: HB ILE 58, Atom 2: H GLN 60
 &rst iat=902, 927, r3=5.500000, r4=6.000000, &end
# Atom 1: HB ILE 58, Atom 2: H PHE 61
 &rst iat=902, 944, r3=6.000000, r4=6.500000, &end
# Atom 1: QG2 ILE 58, Atom 2: H ALA 59
 &rst iat=-1, 917, r3=5.200000, r4=5.700000, igr1=904, 905, 906, &end
# Atom 1: QG2 ILE 58, Atom 2: H GLN 60
 &rst iat=-1, 927, r3=7.000000, r4=7.500000, igr1=904, 905, 906, &end
# Atom 1: QG2 ILE 58, Atom 2: H PHE 61
 &rst iat=-1, 944, r3=6.000000, r4=6.500000, igr1=904, 905, 906, &end
# Atom 1: QG2 ILE 58, Atom 2: H ILE 62
 &rst iat=-1, 964, r3=6.500000, r4=7.000000, igr1=904, 905, 906, &end
# Atom 1: QG2 ILE 58, Atom 2: HNE1 GLN 63
 &rst iat=-1, 995, r3=7.000000, r4=7.500000, igr1=904, 905, 906, &end
# Atom 1: QG2 ILE 58, Atom 2: HNE2 GLN 63
 &rst iat=-1, 996, r3=7.000000, r4=7.500000, igr1=904, 905, 906, &end
# Atom 1: QG1 ILE 58, Atom 2: H ALA 59
 &rst iat=-1, 917, r3=6.880000, r4=7.380000, igr1=908, 909, &end
# Atom 1: QG1 ILE 58, Atom 2: H PHE 61
 &rst iat=-1, 944, r3=6.880000, r4=7.380000, igr1=908, 909, &end
# Atom 1: QD ILE 58, Atom 2: H ALA 59
 &rst iat=-1, 917, r3=7.000000, r4=7.500000, igr1=911, 912, 913, &end
# Atom 1: H ALA 59, Atom 2: H GLN 60
 &rst iat=917, 927, r3=3.600000, r4=4.100000, &end
# Atom 1: H ALA 59, Atom 2: QB GLN 60
 &rst iat=917, -1, r3=5.580000, r4=6.080000, igr2=931, 932, &end
# Atom 1: H ALA 59, Atom 2: H PHE 61
 &rst iat=917, 944, r3=4.800000, r4=5.300000, &end
# Atom 1: H ALA 59, Atom 2: QD PHE 61
 &rst iat=917, -1, r3=8.000000, r4=8.500000, igr2=952, 960, &end
# Atom 1: H ALA 59, Atom 2: H ILE 62
 &rst iat=917, 964, r3=5.100000, r4=5.600000, &end
# Atom 1: HA ALA 59, Atom 2: H PHE 61
 &rst iat=919, 944, r3=5.400000, r4=5.900000, &end
# Atom 1: HA ALA 59, Atom 2: H ILE 62
 &rst iat=919, 964, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ALA 59, Atom 2: QNE GLN 63
 &rst iat=919, -1, r3=6.870000, r4=7.370000, igr2=995, 996, &end
# Atom 1: HA ALA 59, Atom 2: H ALA 69
 &rst iat=919, 1073, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ALA 59, Atom 2: QB ALA 69
 &rst iat=919, -1, r3=5.900000, r4=6.400000, igr2=1077, 1078, 1079, &end
# Atom 1: QB ALA 59, Atom 2: H GLN 60
 &rst iat=-1, 927, r3=4.400000, r4=4.900000, igr1=921, 922, 923, &end
# Atom 1: QB ALA 59, Atom 2: H PHE 61
 &rst iat=-1, 944, r3=6.100000, r4=6.600000, igr1=921, 922, 923, &end
# Atom 1: QB ALA 59, Atom 2: H ILE 62
 &rst iat=-1, 964, r3=5.700000, r4=6.200000, igr1=921, 922, 923, &end
# Atom 1: QB ALA 59, Atom 2: H GLN 63
 &rst iat=-1, 983, r3=5.700000, r4=6.200000, igr1=921, 922, 923, &end
# Atom 1: H GLN 60, Atom 2: HB2 GLN 60
 &rst iat=927, 931, r3=3.500000, r4=4.000000, &end
# Atom 1: H GLN 60, Atom 2: HB3 GLN 60
 &rst iat=927, 932, r3=3.500000, r4=4.000000, &end
# Atom 1: H GLN 60, Atom 2: QG GLN 60
 &rst iat=927, -1, r3=5.200000, r4=5.700000, igr2=934, 935, &end
# Atom 1: H GLN 60, Atom 2: H PHE 61
 &rst iat=927, 944, r3=2.900000, r4=3.400000, &end
# Atom 1: H GLN 60, Atom 2: HA PHE 61
 &rst iat=927, 946, r3=5.400000, r4=5.900000, &end
# Atom 1: H GLN 60, Atom 2: QB PHE 61
 &rst iat=927, -1, r3=5.180000, r4=5.680000, igr2=948, 949, &end
# Atom 1: H GLN 60, Atom 2: QD ILE 62
 &rst iat=927, -1, r3=7.000000, r4=7.500000, igr2=977, 978, 979, &end
# Atom 1: H GLN 60, Atom 2: H GLN 63
 &rst iat=927, 983, r3=5.800000, r4=6.300000, &end
# Atom 1: HA GLN 60, Atom 2: HNE1 GLN 60
 &rst iat=929, 939, r3=5.000000, r4=5.500000, &end
# Atom 1: HA GLN 60, Atom 2: HNE2 GLN 60
 &rst iat=929, 940, r3=5.000000, r4=5.500000, &end
# Atom 1: HA GLN 60, Atom 2: H ILE 62
 &rst iat=929, 964, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLN 60, Atom 2: H GLN 63
 &rst iat=929, 983, r3=5.200000, r4=5.700000, &end
# Atom 1: HA GLN 60, Atom 2: HNE1 GLN 63
 &rst iat=929, 995, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLN 60, Atom 2: HNE2 GLN 63
 &rst iat=929, 996, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLN 60, Atom 2: QNE GLN 63
 &rst iat=929, -1, r3=5.690000, r4=6.190000, igr2=995, 996, &end
# Atom 1: HA GLN 60, Atom 2: H ASP 64
 &rst iat=929, 1000, r3=5.300000, r4=5.800000, &end
# Atom 1: HB2 GLN 60, Atom 2: HNE1 GLN 60
 &rst iat=931, 939, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 GLN 60, Atom 2: HNE2 GLN 60
 &rst iat=931, 940, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 GLN 60, Atom 2: H PHE 61
 &rst iat=931, 944, r3=4.100000, r4=4.600000, &end
# Atom 1: HB2 GLN 60, Atom 2: H ILE 62
 &rst iat=931, 964, r3=5.900000, r4=6.400000, &end
# Atom 1: HB3 GLN 60, Atom 2: HNE1 GLN 60
 &rst iat=932, 939, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 GLN 60, Atom 2: HNE2 GLN 60
 &rst iat=932, 940, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 GLN 60, Atom 2: H PHE 61
 &rst iat=932, 944, r3=4.100000, r4=4.600000, &end
# Atom 1: HB3 GLN 60, Atom 2: H ILE 62
 &rst iat=932, 964, r3=5.900000, r4=6.400000, &end
# Atom 1: QB GLN 60, Atom 2: H PHE 61
 &rst iat=-1, 944, r3=3.900000, r4=4.400000, igr1=931, 932, &end
# Atom 1: QB GLN 60, Atom 2: H ILE 62
 &rst iat=-1, 964, r3=5.400000, r4=5.900000, igr1=931, 932, &end
# Atom 1: QG GLN 60, Atom 2: H PHE 61
 &rst iat=-1, 944, r3=7.000000, r4=7.500000, igr1=934, 935, &end
# Atom 1: HNE1 GLN 60, Atom 2: HG2 GLN 63
 &rst iat=939, 990, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE1 GLN 60, Atom 2: HG3 GLN 63
 &rst iat=939, 991, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE2 GLN 60, Atom 2: HG2 GLN 63
 &rst iat=940, 990, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE2 GLN 60, Atom 2: HG3 GLN 63
 &rst iat=940, 991, r3=6.000000, r4=6.500000, &end
# Atom 1: QNE GLN 60, Atom 2: H PHE 61
 &rst iat=-1, 944, r3=6.870000, r4=7.370000, igr1=939, 940, &end
# Atom 1: QNE GLN 60, Atom 2: QG GLN 63
 &rst iat=-1, -1, r3=5.650000, r4=6.150000, 
 igr1=939, 940, igr2=990, 991, &end
# Atom 1: QNE GLN 60, Atom 2: H ASP 64
 &rst iat=-1, 1000, r3=6.870000, r4=7.370000, igr1=939, 940, &end
# Atom 1: QNE GLN 60, Atom 2: QB ASP 64
 &rst iat=-1, -1, r3=7.740000, r4=8.240000, 
 igr1=939, 940, igr2=1004, 1005, &end
# Atom 1: H PHE 61, Atom 2: HB2 PHE 61
 &rst iat=944, 948, r3=4.100000, r4=4.600000, &end
# Atom 1: H PHE 61, Atom 2: HB3 PHE 61
 &rst iat=944, 949, r3=4.100000, r4=4.600000, &end
# Atom 1: H PHE 61, Atom 2: QB PHE 61
 &rst iat=944, -1, r3=3.620000, r4=4.120000, igr2=948, 949, &end
# Atom 1: H PHE 61, Atom 2: H ILE 62
 &rst iat=944, 964, r3=3.500000, r4=4.000000, &end
# Atom 1: H PHE 61, Atom 2: HG12 ILE 62
 &rst iat=944, 974, r3=6.000000, r4=6.500000, &end
# Atom 1: H PHE 61, Atom 2: HG13 ILE 62
 &rst iat=944, 975, r3=6.000000, r4=6.500000, &end
# Atom 1: H PHE 61, Atom 2: QD ILE 62
 &rst iat=944, -1, r3=7.000000, r4=7.500000, igr2=977, 978, 979, &end
# Atom 1: H PHE 61, Atom 2: H GLN 63
 &rst iat=944, 983, r3=5.100000, r4=5.600000, &end
# Atom 1: H PHE 61, Atom 2: H ASP 64
 &rst iat=944, 1000, r3=5.200000, r4=5.700000, &end
# Atom 1: H PHE 61, Atom 2: QB ASP 64
 &rst iat=944, -1, r3=6.680000, r4=7.180000, igr2=1004, 1005, &end
# Atom 1: HA PHE 61, Atom 2: H GLN 63
 &rst iat=946, 983, r3=5.900000, r4=6.400000, &end
# Atom 1: HA PHE 61, Atom 2: H ASP 64
 &rst iat=946, 1000, r3=4.700000, r4=5.200000, &end
# Atom 1: HB2 PHE 61, Atom 2: H ILE 62
 &rst iat=948, 964, r3=4.400000, r4=4.900000, &end
# Atom 1: HB3 PHE 61, Atom 2: H ILE 62
 &rst iat=949, 964, r3=4.400000, r4=4.900000, &end
# Atom 1: QB PHE 61, Atom 2: H GLN 63
 &rst iat=-1, 983, r3=5.880000, r4=6.380000, igr1=948, 949, &end
# Atom 1: QB PHE 61, Atom 2: H ASP 64
 &rst iat=-1, 1000, r3=6.580000, r4=7.080000, igr1=948, 949, &end
# Atom 1: QD PHE 61, Atom 2: H ILE 62
 &rst iat=-1, 964, r3=8.000000, r4=8.500000, igr1=952, 960, &end
# Atom 1: H ILE 62, Atom 2: HB ILE 62
 &rst iat=964, 968, r3=3.600000, r4=4.100000, &end
# Atom 1: H ILE 62, Atom 2: QG2 ILE 62
 &rst iat=964, -1, r3=4.900000, r4=5.400000, igr2=970, 971, 972, &end
# Atom 1: H ILE 62, Atom 2: HG12 ILE 62
 &rst iat=964, 974, r3=4.100000, r4=4.600000, &end
# Atom 1: H ILE 62, Atom 2: HG13 ILE 62
 &rst iat=964, 975, r3=4.100000, r4=4.600000, &end
# Atom 1: H ILE 62, Atom 2: QG1 ILE 62
 &rst iat=964, -1, r3=3.810000, r4=4.310000, igr2=974, 975, &end
# Atom 1: H ILE 62, Atom 2: QD ILE 62
 &rst iat=964, -1, r3=4.900000, r4=5.400000, igr2=977, 978, 979, &end
# Atom 1: H ILE 62, Atom 2: H GLN 63
 &rst iat=964, 983, r3=3.600000, r4=4.100000, &end
# Atom 1: H ILE 62, Atom 2: HA GLN 63
 &rst iat=964, 985, r3=5.500000, r4=6.000000, &end
# Atom 1: H ILE 62, Atom 2: QB GLN 63
 &rst iat=964, -1, r3=5.680000, r4=6.180000, igr2=987, 988, &end
# Atom 1: H ILE 62, Atom 2: H ASP 64
 &rst iat=964, 1000, r3=5.400000, r4=5.900000, &end
# Atom 1: HA ILE 62, Atom 2: H ASP 64
 &rst iat=966, 1000, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ILE 62, Atom 2: H LEU 65
 &rst iat=966, 1012, r3=4.800000, r4=5.300000, &end
# Atom 1: HB ILE 62, Atom 2: H ASP 64
 &rst iat=968, 1000, r3=5.500000, r4=6.000000, &end
# Atom 1: HB ILE 62, Atom 2: QB ALA 69
 &rst iat=968, -1, r3=4.600000, r4=5.100000, igr2=1077, 1078, 1079, &end
# Atom 1: QG2 ILE 62, Atom 2: H GLN 63
 &rst iat=-1, 983, r3=5.900000, r4=6.400000, igr1=970, 971, 972, &end
# Atom 1: QG2 ILE 62, Atom 2: HNE1 GLN 63
 &rst iat=-1, 995, r3=7.000000, r4=7.500000, igr1=970, 971, 972, &end
# Atom 1: QG2 ILE 62, Atom 2: HNE2 GLN 63
 &rst iat=-1, 996, r3=7.000000, r4=7.500000, igr1=970, 971, 972, &end
# Atom 1: QG2 ILE 62, Atom 2: H ASP 64
 &rst iat=-1, 1000, r3=7.000000, r4=7.500000, igr1=970, 971, 972, &end
# Atom 1: QG2 ILE 62, Atom 2: H PHE 67
 &rst iat=-1, 1038, r3=6.200000, r4=6.700000, igr1=970, 971, 972, &end
# Atom 1: QG2 ILE 62, Atom 2: H GLU 68
 &rst iat=-1, 1058, r3=7.000000, r4=7.500000, igr1=970, 971, 972, &end
# Atom 1: QG2 ILE 62, Atom 2: HA GLU 68
 &rst iat=-1, 1060, r3=6.600000, r4=7.100000, igr1=970, 971, 972, &end
# Atom 1: QG2 ILE 62, Atom 2: H ALA 69
 &rst iat=-1, 1073, r3=7.000000, r4=7.500000, igr1=970, 971, 972, &end
# Atom 1: QG2 ILE 62, Atom 2: QB ALA 69
 &rst iat=-1, -1, r3=4.700000, r4=5.200000, 
 igr1=970, 971, 972, igr2=1077, 1078, 1079, &end
# Atom 1: QG2 ILE 62, Atom 2: H ALA 70
 &rst iat=-1, 1083, r3=7.000000, r4=7.500000, igr1=970, 971, 972, &end
# Atom 1: QG1 ILE 62, Atom 2: H GLN 63
 &rst iat=-1, 983, r3=5.480000, r4=5.980000, igr1=974, 975, &end
# Atom 1: QG1 ILE 62, Atom 2: H LEU 65
 &rst iat=-1, 1012, r3=6.880000, r4=7.380000, igr1=974, 975, &end
# Atom 1: QG1 ILE 62, Atom 2: H PHE 67
 &rst iat=-1, 1038, r3=6.880000, r4=7.380000, igr1=974, 975, &end
# Atom 1: QG1 ILE 62, Atom 2: HA GLU 68
 &rst iat=-1, 1060, r3=6.880000, r4=7.380000, igr1=974, 975, &end
# Atom 1: QG1 ILE 62, Atom 2: QB ALA 69
 &rst iat=-1, -1, r3=4.580000, r4=5.080000, 
 igr1=974, 975, igr2=1077, 1078, 1079, &end
# Atom 1: QD ILE 62, Atom 2: H ASP 64
 &rst iat=-1, 1000, r3=7.000000, r4=7.500000, igr1=977, 978, 979, &end
# Atom 1: QD ILE 62, Atom 2: H PHE 67
 &rst iat=-1, 1038, r3=6.400000, r4=6.900000, igr1=977, 978, 979, &end
# Atom 1: H GLN 63, Atom 2: HB2 GLN 63
 &rst iat=983, 987, r3=3.600000, r4=4.100000, &end
# Atom 1: H GLN 63, Atom 2: HB3 GLN 63
 &rst iat=983, 988, r3=3.600000, r4=4.100000, &end
# Atom 1: H GLN 63, Atom 2: HG2 GLN 63
 &rst iat=983, 990, r3=4.300000, r4=4.800000, &end
# Atom 1: H GLN 63, Atom 2: HG3 GLN 63
 &rst iat=983, 991, r3=4.300000, r4=4.800000, &end
# Atom 1: H GLN 63, Atom 2: QG GLN 63
 &rst iat=983, -1, r3=4.110000, r4=4.610000, igr2=990, 991, &end
# Atom 1: H GLN 63, Atom 2: HNE1 GLN 63
 &rst iat=983, 995, r3=5.700000, r4=6.200000, &end
# Atom 1: H GLN 63, Atom 2: HNE2 GLN 63
 &rst iat=983, 996, r3=5.700000, r4=6.200000, &end
# Atom 1: H GLN 63, Atom 2: QNE GLN 63
 &rst iat=983, -1, r3=5.290000, r4=5.790000, igr2=995, 996, &end
# Atom 1: H GLN 63, Atom 2: H ASP 64
 &rst iat=983, 1000, r3=3.700000, r4=4.200000, &end
# Atom 1: H GLN 63, Atom 2: QB ASP 64
 &rst iat=983, -1, r3=6.480000, r4=6.980000, igr2=1004, 1005, &end
# Atom 1: H GLN 63, Atom 2: H LEU 65
 &rst iat=983, 1012, r3=5.300000, r4=5.800000, &end
# Atom 1: H GLN 63, Atom 2: H GLY 66
 &rst iat=983, 1031, r3=5.900000, r4=6.400000, &end
# Atom 1: H GLN 63, Atom 2: H PHE 67
 &rst iat=983, 1038, r3=4.900000, r4=5.400000, &end
# Atom 1: HA GLN 63, Atom 2: H LEU 65
 &rst iat=985, 1012, r3=5.500000, r4=6.000000, &end
# Atom 1: HA GLN 63, Atom 2: H GLY 66
 &rst iat=985, 1031, r3=4.900000, r4=5.400000, &end
# Atom 1: HA GLN 63, Atom 2: H PHE 67
 &rst iat=985, 1038, r3=4.700000, r4=5.200000, &end
# Atom 1: HA GLN 63, Atom 2: H ALA 69
 &rst iat=985, 1073, r3=5.700000, r4=6.200000, &end
# Atom 1: HB2 GLN 63, Atom 2: HNE1 GLN 63
 &rst iat=987, 995, r3=5.400000, r4=5.900000, &end
# Atom 1: HB2 GLN 63, Atom 2: HNE2 GLN 63
 &rst iat=987, 996, r3=5.400000, r4=5.900000, &end
# Atom 1: HB2 GLN 63, Atom 2: H ASP 64
 &rst iat=987, 1000, r3=3.800000, r4=4.300000, &end
# Atom 1: HB3 GLN 63, Atom 2: HNE1 GLN 63
 &rst iat=988, 995, r3=5.400000, r4=5.900000, &end
# Atom 1: HB3 GLN 63, Atom 2: HNE2 GLN 63
 &rst iat=988, 996, r3=5.400000, r4=5.900000, &end
# Atom 1: HB3 GLN 63, Atom 2: H ASP 64
 &rst iat=988, 1000, r3=3.800000, r4=4.300000, &end
# Atom 1: QB GLN 63, Atom 2: QNE GLN 63
 &rst iat=-1, -1, r3=4.700000, r4=5.200000, 
 igr1=987, 988, igr2=995, 996, &end
# Atom 1: QB GLN 63, Atom 2: H GLY 66
 &rst iat=-1, 1031, r3=6.880000, r4=7.380000, igr1=987, 988, &end
# Atom 1: QB GLN 63, Atom 2: H ALA 69
 &rst iat=-1, 1073, r3=6.680000, r4=7.180000, igr1=987, 988, &end
# Atom 1: HG2 GLN 63, Atom 2: HA GLU 68
 &rst iat=990, 1060, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 GLN 63, Atom 2: H ALA 69
 &rst iat=990, 1073, r3=5.900000, r4=6.400000, &end
# Atom 1: HG3 GLN 63, Atom 2: HA GLU 68
 &rst iat=991, 1060, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLN 63, Atom 2: H ALA 69
 &rst iat=991, 1073, r3=5.900000, r4=6.400000, &end
# Atom 1: QG GLN 63, Atom 2: H GLY 66
 &rst iat=-1, 1031, r3=6.880000, r4=7.380000, igr1=990, 991, &end
# Atom 1: QG GLN 63, Atom 2: H PHE 67
 &rst iat=-1, 1038, r3=6.880000, r4=7.380000, igr1=990, 991, &end
# Atom 1: QG GLN 63, Atom 2: H ALA 69
 &rst iat=-1, 1073, r3=5.640000, r4=6.140000, igr1=990, 991, &end
# Atom 1: HNE1 GLN 63, Atom 2: HA GLU 68
 &rst iat=995, 1060, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE1 GLN 63, Atom 2: HB2 GLU 68
 &rst iat=995, 1062, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE1 GLN 63, Atom 2: HB3 GLU 68
 &rst iat=995, 1063, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE1 GLN 63, Atom 2: H ALA 69
 &rst iat=995, 1073, r3=5.600000, r4=6.100000, &end
# Atom 1: HNE1 GLN 63, Atom 2: QB ALA 69
 &rst iat=995, -1, r3=5.900000, r4=6.400000, igr2=1077, 1078, 1079, &end
# Atom 1: HNE2 GLN 63, Atom 2: HA GLU 68
 &rst iat=996, 1060, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE2 GLN 63, Atom 2: HB2 GLU 68
 &rst iat=996, 1062, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE2 GLN 63, Atom 2: HB3 GLU 68
 &rst iat=996, 1063, r3=7.750000, r4=8.250000, &end
# Atom 1: HNE2 GLN 63, Atom 2: H ALA 69
 &rst iat=996, 1073, r3=5.600000, r4=6.100000, &end
# Atom 1: HNE2 GLN 63, Atom 2: QB ALA 69
 &rst iat=996, -1, r3=5.900000, r4=6.400000, igr2=1077, 1078, 1079, &end
# Atom 1: QNE GLN 63, Atom 2: QB GLU 68
 &rst iat=-1, -1, r3=6.820000, r4=7.320000, 
 igr1=995, 996, igr2=1062, 1063, &end
# Atom 1: QNE GLN 63, Atom 2: H ALA 69
 &rst iat=-1, 1073, r3=5.380000, r4=5.880000, igr1=995, 996, &end
# Atom 1: QNE GLN 63, Atom 2: QB ALA 69
 &rst iat=-1, -1, r3=5.740000, r4=6.240000, 
 igr1=995, 996, igr2=1077, 1078, 1079, &end
# Atom 1: H ASP 64, Atom 2: HB2 ASP 64
 &rst iat=1000, 1004, r3=3.500000, r4=4.000000, &end
# Atom 1: H ASP 64, Atom 2: HB3 ASP 64
 &rst iat=1000, 1005, r3=3.500000, r4=4.000000, &end
# Atom 1: H ASP 64, Atom 2: H LEU 65
 &rst iat=1000, 1012, r3=3.800000, r4=4.300000, &end
# Atom 1: H ASP 64, Atom 2: HA LEU 65
 &rst iat=1000, 1014, r3=5.300000, r4=5.800000, &end
# Atom 1: H ASP 64, Atom 2: QQD LEU 65
 &rst iat=1000, -1, r3=8.570000, r4=9.070000, igr2=1021, 1022, 1023, 1025, 1026, 1027, &end
# Atom 1: H ASP 64, Atom 2: H GLY 66
 &rst iat=1000, 1031, r3=5.700000, r4=6.200000, &end
# Atom 1: H ASP 64, Atom 2: H PHE 67
 &rst iat=1000, 1038, r3=5.400000, r4=5.900000, &end
# Atom 1: HA ASP 64, Atom 2: H GLY 66
 &rst iat=1002, 1031, r3=5.300000, r4=5.800000, &end
# Atom 1: HB2 ASP 64, Atom 2: H LEU 65
 &rst iat=1004, 1012, r3=4.400000, r4=4.900000, &end
# Atom 1: HB2 ASP 64, Atom 2: H GLY 66
 &rst iat=1004, 1031, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 ASP 64, Atom 2: H LEU 65
 &rst iat=1005, 1012, r3=4.400000, r4=4.900000, &end
# Atom 1: HB3 ASP 64, Atom 2: H GLY 66
 &rst iat=1005, 1031, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 65, Atom 2: HB2 LEU 65
 &rst iat=1012, 1016, r3=3.900000, r4=4.400000, &end
# Atom 1: H LEU 65, Atom 2: HB3 LEU 65
 &rst iat=1012, 1017, r3=3.900000, r4=4.400000, &end
# Atom 1: H LEU 65, Atom 2: QB LEU 65
 &rst iat=1012, -1, r3=3.600000, r4=4.100000, igr2=1016, 1017, &end
# Atom 1: H LEU 65, Atom 2: HG LEU 65
 &rst iat=1012, 1019, r3=3.700000, r4=4.200000, &end
# Atom 1: H LEU 65, Atom 2: QD1 LEU 65
 &rst iat=1012, -1, r3=4.900000, r4=5.400000, igr2=1021, 1022, 1023, &end
# Atom 1: H LEU 65, Atom 2: QD2 LEU 65
 &rst iat=1012, -1, r3=4.900000, r4=5.400000, igr2=1025, 1026, 1027, &end
# Atom 1: H LEU 65, Atom 2: H GLY 66
 &rst iat=1012, 1031, r3=3.600000, r4=4.100000, &end
# Atom 1: H LEU 65, Atom 2: QA GLY 66
 &rst iat=1012, -1, r3=6.180000, r4=6.680000, igr2=1033, 1034, &end
# Atom 1: H LEU 65, Atom 2: H PHE 67
 &rst iat=1012, 1038, r3=4.900000, r4=5.400000, &end
# Atom 1: H LEU 65, Atom 2: QD PHE 67
 &rst iat=1012, -1, r3=7.800000, r4=8.300000, igr2=1046, 1054, &end
# Atom 1: HA LEU 65, Atom 2: H PHE 67
 &rst iat=1014, 1038, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 LEU 65, Atom 2: H GLY 66
 &rst iat=1016, 1031, r3=5.000000, r4=5.500000, &end
# Atom 1: HB2 LEU 65, Atom 2: H PHE 67
 &rst iat=1016, 1038, r3=5.600000, r4=6.100000, &end
# Atom 1: HB3 LEU 65, Atom 2: H GLY 66
 &rst iat=1017, 1031, r3=5.000000, r4=5.500000, &end
# Atom 1: HB3 LEU 65, Atom 2: H PHE 67
 &rst iat=1017, 1038, r3=5.600000, r4=6.100000, &end
# Atom 1: QB LEU 65, Atom 2: H GLY 66
 &rst iat=-1, 1031, r3=4.720000, r4=5.220000, igr1=1016, 1017, &end
# Atom 1: QB LEU 65, Atom 2: H PHE 67
 &rst iat=-1, 1038, r3=5.090000, r4=5.590000, igr1=1016, 1017, &end
# Atom 1: HG LEU 65, Atom 2: H GLY 66
 &rst iat=1019, 1031, r3=6.000000, r4=6.500000, &end
# Atom 1: QD1 LEU 65, Atom 2: H GLY 66
 &rst iat=-1, 1031, r3=7.000000, r4=7.500000, igr1=1021, 1022, 1023, &end
# Atom 1: QD2 LEU 65, Atom 2: H GLY 66
 &rst iat=-1, 1031, r3=7.000000, r4=7.500000, igr1=1025, 1026, 1027, &end
# Atom 1: H GLY 66, Atom 2: H PHE 67
 &rst iat=1031, 1038, r3=3.400000, r4=3.900000, &end
# Atom 1: H GLY 66, Atom 2: HB2 PHE 67
 &rst iat=1031, 1042, r3=5.300000, r4=5.800000, &end
# Atom 1: H GLY 66, Atom 2: HB3 PHE 67
 &rst iat=1031, 1043, r3=5.300000, r4=5.800000, &end
# Atom 1: H GLY 66, Atom 2: QB PHE 67
 &rst iat=1031, -1, r3=4.840000, r4=5.340000, igr2=1042, 1043, &end
# Atom 1: H PHE 67, Atom 2: QE PHE 67
 &rst iat=1038, -1, r3=6.300000, r4=6.800000, igr2=1048, 1052, &end
# Atom 1: HA PHE 67, Atom 2: H GLU 68
 &rst iat=1040, 1058, r3=3.200000, r4=3.700000, &end
# Atom 1: HB2 PHE 67, Atom 2: H GLU 68
 &rst iat=1042, 1058, r3=4.100000, r4=4.600000, &end
# Atom 1: HB3 PHE 67, Atom 2: H GLU 68
 &rst iat=1043, 1058, r3=4.100000, r4=4.600000, &end
# Atom 1: QB PHE 67, Atom 2: H GLU 68
 &rst iat=-1, 1058, r3=3.810000, r4=4.310000, igr1=1042, 1043, &end
# Atom 1: QD PHE 67, Atom 2: H GLU 68
 &rst iat=-1, 1058, r3=8.000000, r4=8.500000, igr1=1046, 1054, &end
# Atom 1: H GLU 68, Atom 2: HB2 GLU 68
 &rst iat=1058, 1062, r3=3.700000, r4=4.200000, &end
# Atom 1: H GLU 68, Atom 2: HB3 GLU 68
 &rst iat=1058, 1063, r3=3.700000, r4=4.200000, &end
# Atom 1: H GLU 68, Atom 2: HG2 GLU 68
 &rst iat=1058, 1065, r3=4.300000, r4=4.800000, &end
# Atom 1: H GLU 68, Atom 2: HG3 GLU 68
 &rst iat=1058, 1066, r3=4.300000, r4=4.800000, &end
# Atom 1: H GLU 68, Atom 2: H ALA 69
 &rst iat=1058, 1073, r3=4.400000, r4=4.900000, &end
# Atom 1: H GLU 68, Atom 2: HA ALA 69
 &rst iat=1058, 1075, r3=5.900000, r4=6.400000, &end
# Atom 1: HA GLU 68, Atom 2: H ALA 69
 &rst iat=1060, 1073, r3=3.000000, r4=3.500000, &end
# Atom 1: HA GLU 68, Atom 2: HA ALA 69
 &rst iat=1060, 1075, r3=5.100000, r4=5.600000, &end
# Atom 1: HB2 GLU 68, Atom 2: H ALA 69
 &rst iat=1062, 1073, r3=4.400000, r4=4.900000, &end
# Atom 1: HB2 GLU 68, Atom 2: H ALA 70
 &rst iat=1062, 1083, r3=5.400000, r4=5.900000, &end
# Atom 1: HB3 GLU 68, Atom 2: H ALA 69
 &rst iat=1063, 1073, r3=4.400000, r4=4.900000, &end
# Atom 1: HB3 GLU 68, Atom 2: H ALA 70
 &rst iat=1063, 1083, r3=5.400000, r4=5.900000, &end
# Atom 1: QB GLU 68, Atom 2: H ALA 70
 &rst iat=-1, 1083, r3=5.230000, r4=5.730000, igr1=1062, 1063, &end
# Atom 1: QG GLU 68, Atom 2: H ALA 69
 &rst iat=-1, 1073, r3=6.880000, r4=7.380000, igr1=1065, 1066, &end
# Atom 1: H ALA 69, Atom 2: H ALA 70
 &rst iat=1073, 1083, r3=4.600000, r4=5.100000, &end
# Atom 1: H ALA 69, Atom 2: QB ALA 70
 &rst iat=1073, -1, r3=6.800000, r4=7.300000, igr2=1087, 1088, 1089, &end
# Atom 1: HA ALA 69, Atom 2: H ALA 70
 &rst iat=1075, 1083, r3=3.100000, r4=3.600000, &end
# Atom 1: HA ALA 69, Atom 2: HA ALA 70
 &rst iat=1075, 1085, r3=4.900000, r4=5.400000, &end
# Atom 1: HA ALA 69, Atom 2: QB ALA 70
 &rst iat=1075, -1, r3=5.100000, r4=5.600000, igr2=1087, 1088, 1089, &end
# Atom 1: H ALA 70, Atom 2: H VAL 71
 &rst iat=1083, 1093, r3=4.400000, r4=4.900000, &end
# Atom 1: HA ALA 70, Atom 2: H VAL 71
 &rst iat=1085, 1093, r3=3.000000, r4=3.500000, &end
# Atom 1: HA ALA 70, Atom 2: HA VAL 71
 &rst iat=1085, 1095, r3=5.100000, r4=5.600000, &end
# Atom 1: HA ALA 70, Atom 2: HB VAL 71
 &rst iat=1085, 1097, r3=4.800000, r4=5.300000, &end
# Atom 1: HA ALA 70, Atom 2: QG1 VAL 71
 &rst iat=1085, -1, r3=7.000000, r4=7.500000, igr2=1099, 1100, 1101, &end
# Atom 1: HA ALA 70, Atom 2: QG2 VAL 71
 &rst iat=1085, -1, r3=7.000000, r4=7.500000, igr2=1103, 1104, 1105, &end
# Atom 1: HA ALA 70, Atom 2: QQG VAL 71
 &rst iat=1085, -1, r3=6.100000, r4=6.600000, igr2=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: QB ALA 70, Atom 2: H VAL 71
 &rst iat=-1, 1093, r3=4.300000, r4=4.800000, igr1=1087, 1088, 1089, &end
# Atom 1: QB ALA 70, Atom 2: HA VAL 71
 &rst iat=-1, 1095, r3=7.000000, r4=7.500000, igr1=1087, 1088, 1089, &end
# Atom 1: H VAL 71, Atom 2: HB VAL 71
 &rst iat=1093, 1097, r3=3.300000, r4=3.800000, &end
# Atom 1: H VAL 71, Atom 2: QG1 VAL 71
 &rst iat=1093, -1, r3=4.700000, r4=5.200000, igr2=1099, 1100, 1101, &end
# Atom 1: H VAL 71, Atom 2: QG2 VAL 71
 &rst iat=1093, -1, r3=4.700000, r4=5.200000, igr2=1103, 1104, 1105, &end
# Atom 1: H VAL 71, Atom 2: QQG VAL 71
 &rst iat=1093, -1, r3=4.080000, r4=4.580000, igr2=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: H VAL 71, Atom 2: QG MET 72
 &rst iat=1093, -1, r3=7.000000, r4=7.500000, igr2=1116, 1117, &end
# Atom 1: H VAL 71, Atom 2: H GLU 73
 &rst iat=1093, 1128, r3=5.500000, r4=6.000000, &end
# Atom 1: H VAL 71, Atom 2: HA GLU 73
 &rst iat=1093, 1130, r3=6.000000, r4=6.500000, &end
# Atom 1: HA VAL 71, Atom 2: HA MET 72
 &rst iat=1095, 1111, r3=5.400000, r4=5.900000, &end
# Atom 1: HA VAL 71, Atom 2: QB MET 72
 &rst iat=1095, -1, r3=5.580000, r4=6.080000, igr2=1113, 1114, &end
# Atom 1: HA VAL 71, Atom 2: QG MET 72
 &rst iat=1095, -1, r3=7.000000, r4=7.500000, igr2=1116, 1117, &end
# Atom 1: HA VAL 71, Atom 2: H GLU 73
 &rst iat=1095, 1128, r3=6.000000, r4=6.500000, &end
# Atom 1: HB VAL 71, Atom 2: H TYR 75
 &rst iat=1097, 1155, r3=5.000000, r4=5.500000, &end
# Atom 1: QG1 VAL 71, Atom 2: H MET 72
 &rst iat=-1, 1109, r3=6.300000, r4=6.800000, igr1=1099, 1100, 1101, &end
# Atom 1: QG1 VAL 71, Atom 2: HB2 MET 72
 &rst iat=-1, 1113, r3=8.150000, r4=8.650000, igr1=1099, 1100, 1101, &end
# Atom 1: QG1 VAL 71, Atom 2: HB3 MET 72
 &rst iat=-1, 1114, r3=8.150000, r4=8.650000, igr1=1099, 1100, 1101, &end
# Atom 1: QG1 VAL 71, Atom 2: QG MET 72
 &rst iat=-1, -1, r3=7.900000, r4=8.400000, 
 igr1=1099, 1100, 1101, igr2=1116, 1117, &end
# Atom 1: QG1 VAL 71, Atom 2: H GLU 73
 &rst iat=-1, 1128, r3=7.000000, r4=7.500000, igr1=1099, 1100, 1101, &end
# Atom 1: QG1 VAL 71, Atom 2: HA GLU 73
 &rst iat=-1, 1130, r3=5.800000, r4=6.300000, igr1=1099, 1100, 1101, &end
# Atom 1: QG2 VAL 71, Atom 2: H MET 72
 &rst iat=-1, 1109, r3=6.300000, r4=6.800000, igr1=1103, 1104, 1105, &end
# Atom 1: QG2 VAL 71, Atom 2: HB2 MET 72
 &rst iat=-1, 1113, r3=8.150000, r4=8.650000, igr1=1103, 1104, 1105, &end
# Atom 1: QG2 VAL 71, Atom 2: HB3 MET 72
 &rst iat=-1, 1114, r3=8.150000, r4=8.650000, igr1=1103, 1104, 1105, &end
# Atom 1: QG2 VAL 71, Atom 2: QG MET 72
 &rst iat=-1, -1, r3=7.900000, r4=8.400000, 
 igr1=1103, 1104, 1105, igr2=1116, 1117, &end
# Atom 1: QG2 VAL 71, Atom 2: H GLU 73
 &rst iat=-1, 1128, r3=7.000000, r4=7.500000, igr1=1103, 1104, 1105, &end
# Atom 1: QG2 VAL 71, Atom 2: HA GLU 73
 &rst iat=-1, 1130, r3=5.800000, r4=6.300000, igr1=1103, 1104, 1105, &end
# Atom 1: QQG VAL 71, Atom 2: H MET 72
 &rst iat=-1, 1109, r3=5.750000, r4=6.250000, igr1=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: QQG VAL 71, Atom 2: HA MET 72
 &rst iat=-1, 1111, r3=7.460000, r4=7.960000, igr1=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: QQG VAL 71, Atom 2: QB MET 72
 &rst iat=-1, -1, r3=6.570000, r4=7.070000, 
 igr1=1099, 1100, 1101, 1103, 1104, 1105, igr2=1113, 1114, &end
# Atom 1: QQG VAL 71, Atom 2: QG MET 72
 &rst iat=-1, -1, r3=7.350000, r4=7.850000, 
 igr1=1099, 1100, 1101, 1103, 1104, 1105, igr2=1116, 1117, &end
# Atom 1: QQG VAL 71, Atom 2: H GLU 73
 &rst iat=-1, 1128, r3=6.570000, r4=7.070000, igr1=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: QQG VAL 71, Atom 2: HA GLU 73
 &rst iat=-1, 1130, r3=5.430000, r4=5.930000, igr1=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: QQG VAL 71, Atom 2: H ASP 74
 &rst iat=-1, 1143, r3=8.560000, r4=9.060000, igr1=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: QQG VAL 71, Atom 2: H TYR 75
 &rst iat=-1, 1155, r3=8.360000, r4=8.860000, igr1=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: QQG VAL 71, Atom 2: HA ALA 76
 &rst iat=-1, 1178, r3=8.560000, r4=9.060000, igr1=1099, 1100, 1101, 1103, 1104, 1105, &end
# Atom 1: H MET 72, Atom 2: QG MET 72
 &rst iat=1109, -1, r3=5.400000, r4=5.900000, igr2=1116, 1117, &end
# Atom 1: H MET 72, Atom 2: H GLU 73
 &rst iat=1109, 1128, r3=4.500000, r4=5.000000, &end
# Atom 1: H MET 72, Atom 2: QG GLU 73
 &rst iat=1109, -1, r3=7.000000, r4=7.500000, igr2=1135, 1136, &end
# Atom 1: H MET 72, Atom 2: H ASP 74
 &rst iat=1109, 1143, r3=5.900000, r4=6.400000, &end
# Atom 1: H MET 72, Atom 2: H TYR 75
 &rst iat=1109, 1155, r3=6.000000, r4=6.500000, &end
# Atom 1: QB MET 72, Atom 2: H GLU 73
 &rst iat=-1, 1128, r3=4.480000, r4=4.980000, igr1=1113, 1114, &end
# Atom 1: QB MET 72, Atom 2: QB TYR 75
 &rst iat=-1, -1, r3=7.880000, r4=8.380000, 
 igr1=1113, 1114, igr2=1159, 1160, &end
# Atom 1: QG MET 72, Atom 2: H GLU 73
 &rst iat=-1, 1128, r3=7.000000, r4=7.500000, igr1=1116, 1117, &end
# Atom 1: QG MET 72, Atom 2: HA GLU 73
 &rst iat=-1, 1130, r3=7.000000, r4=7.500000, igr1=1116, 1117, &end
# Atom 1: H GLU 73, Atom 2: HB2 GLU 73
 &rst iat=1128, 1132, r3=3.900000, r4=4.400000, &end
# Atom 1: H GLU 73, Atom 2: HB3 GLU 73
 &rst iat=1128, 1133, r3=3.900000, r4=4.400000, &end
# Atom 1: H GLU 73, Atom 2: QB GLU 73
 &rst iat=1128, -1, r3=3.650000, r4=4.150000, igr2=1132, 1133, &end
# Atom 1: H GLU 73, Atom 2: QG GLU 73
 &rst iat=1128, -1, r3=5.500000, r4=6.000000, igr2=1135, 1136, &end
# Atom 1: H GLU 73, Atom 2: HB2 ASP 74
 &rst iat=1128, 1147, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLU 73, Atom 2: HB3 ASP 74
 &rst iat=1128, 1148, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLU 73, Atom 2: QB ASP 74
 &rst iat=1128, -1, r3=5.500000, r4=6.000000, igr2=1147, 1148, &end
# Atom 1: H GLU 73, Atom 2: H TYR 75
 &rst iat=1128, 1155, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 GLU 73, Atom 2: H ASP 74
 &rst iat=1132, 1143, r3=4.800000, r4=5.300000, &end
# Atom 1: HB3 GLU 73, Atom 2: H ASP 74
 &rst iat=1133, 1143, r3=4.800000, r4=5.300000, &end
# Atom 1: QB GLU 73, Atom 2: H ASP 74
 &rst iat=-1, 1143, r3=4.470000, r4=4.970000, igr1=1132, 1133, &end
# Atom 1: QG GLU 73, Atom 2: H ASP 74
 &rst iat=-1, 1143, r3=7.000000, r4=7.500000, igr1=1135, 1136, &end
# Atom 1: H ASP 74, Atom 2: QB ASP 74
 &rst iat=1143, -1, r3=3.900000, r4=4.400000, igr2=1147, 1148, &end
# Atom 1: H ASP 74, Atom 2: H TYR 75
 &rst iat=1143, 1155, r3=4.300000, r4=4.800000, &end
# Atom 1: H ASP 74, Atom 2: QB TYR 75
 &rst iat=1143, -1, r3=7.000000, r4=7.500000, igr2=1159, 1160, &end
# Atom 1: H ASP 74, Atom 2: QD TYR 75
 &rst iat=1143, -1, r3=8.000000, r4=8.500000, igr2=1163, 1172, &end
# Atom 1: HA ASP 74, Atom 2: QB TYR 75
 &rst iat=1145, -1, r3=6.500000, r4=7.000000, igr2=1159, 1160, &end
# Atom 1: HA ASP 74, Atom 2: QD TYR 75
 &rst iat=1145, -1, r3=8.000000, r4=8.500000, igr2=1163, 1172, &end
# Atom 1: HB2 ASP 74, Atom 2: H TYR 75
 &rst iat=1147, 1155, r3=4.500000, r4=5.000000, &end
# Atom 1: HB2 ASP 74, Atom 2: H ALA 76
 &rst iat=1147, 1176, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 ASP 74, Atom 2: H TYR 75
 &rst iat=1148, 1155, r3=4.500000, r4=5.000000, &end
# Atom 1: HB3 ASP 74, Atom 2: H ALA 76
 &rst iat=1148, 1176, r3=6.000000, r4=6.500000, &end
# Atom 1: QB ASP 74, Atom 2: H TYR 75
 &rst iat=-1, 1155, r3=4.210000, r4=4.710000, igr1=1147, 1148, &end
# Atom 1: QB ASP 74, Atom 2: HA ALA 76
 &rst iat=-1, 1178, r3=6.880000, r4=7.380000, igr1=1147, 1148, &end
# Atom 1: H TYR 75, Atom 2: QE TYR 75
 &rst iat=1155, -1, r3=7.000000, r4=7.500000, igr2=1165, 1170, &end
# Atom 1: H TYR 75, Atom 2: H ALA 76
 &rst iat=1155, 1176, r3=4.100000, r4=4.600000, &end
# Atom 1: H TYR 75, Atom 2: HA ALA 76
 &rst iat=1155, 1178, r3=6.000000, r4=6.500000, &end
# Atom 1: H TYR 75, Atom 2: QB ALA 76
 &rst iat=1155, -1, r3=6.200000, r4=6.700000, igr2=1180, 1181, 1182, &end
# Atom 1: HA TYR 75, Atom 2: HA ALA 76
 &rst iat=1157, 1178, r3=5.600000, r4=6.100000, &end
# Atom 1: QB TYR 75, Atom 2: HA ALA 76
 &rst iat=-1, 1178, r3=7.000000, r4=7.500000, igr1=1159, 1160, &end
# Atom 1: QB TYR 75, Atom 2: QB ALA 76
 &rst iat=-1, -1, r3=8.000000, r4=8.500000, 
 igr1=1159, 1160, igr2=1180, 1181, 1182, &end
# Atom 1: QB TYR 75, Atom 2: H GLY 77
 &rst iat=-1, 1186, r3=7.000000, r4=7.500000, igr1=1159, 1160, &end
# Atom 1: QB TYR 75, Atom 2: QB ASN 81
 &rst iat=-1, -1, r3=7.880000, r4=8.380000, 
 igr1=1159, 1160, igr2=1227, 1228, &end
# Atom 1: QB TYR 75, Atom 2: QND ASN 81
 &rst iat=-1, -1, r3=7.870000, r4=8.370000, 
 igr1=1159, 1160, igr2=1232, 1233, &end
# Atom 1: QB TYR 75, Atom 2: QB GLU 83
 &rst iat=-1, -1, r3=7.880000, r4=8.380000, 
 igr1=1159, 1160, igr2=1260, 1261, &end
# Atom 1: QB TYR 75, Atom 2: QG GLU 83
 &rst iat=-1, -1, r3=7.880000, r4=8.380000, 
 igr1=1159, 1160, igr2=1263, 1264, &end
# Atom 1: QB TYR 75, Atom 2: HG LEU 121
 &rst iat=-1, 1824, r3=7.000000, r4=7.500000, igr1=1159, 1160, &end
# Atom 1: QB TYR 75, Atom 2: QD1 LEU 121
 &rst iat=-1, -1, r3=8.000000, r4=8.500000, 
 igr1=1159, 1160, igr2=1826, 1827, 1828, &end
# Atom 1: QB TYR 75, Atom 2: QD2 LEU 121
 &rst iat=-1, -1, r3=8.000000, r4=8.500000, 
 igr1=1159, 1160, igr2=1830, 1831, 1832, &end
# Atom 1: QD TYR 75, Atom 2: H ALA 76
 &rst iat=-1, 1176, r3=8.000000, r4=8.500000, igr1=1163, 1172, &end
# Atom 1: QD TYR 75, Atom 2: HA ALA 76
 &rst iat=-1, 1178, r3=8.000000, r4=8.500000, igr1=1163, 1172, &end
# Atom 1: QD TYR 75, Atom 2: QB ALA 76
 &rst iat=-1, -1, r3=9.000000, r4=9.500000, 
 igr1=1163, 1172, igr2=1180, 1181, 1182, &end
# Atom 1: QD TYR 75, Atom 2: H GLY 77
 &rst iat=-1, 1186, r3=8.000000, r4=8.500000, igr1=1163, 1172, &end
# Atom 1: QD TYR 75, Atom 2: H VAL 122
 &rst iat=-1, 1836, r3=8.000000, r4=8.500000, igr1=1163, 1172, &end
# Atom 1: QE TYR 75, Atom 2: HA2 GLY 77
 &rst iat=-1, 1188, r3=8.000000, r4=8.500000, igr1=1165, 1170, &end
# Atom 1: QE TYR 75, Atom 2: HA3 GLY 77
 &rst iat=-1, 1189, r3=8.000000, r4=8.500000, igr1=1165, 1170, &end
# Atom 1: QE TYR 75, Atom 2: HB2 SER 78
 &rst iat=-1, 1197, r3=8.000000, r4=8.500000, igr1=1165, 1170, &end
# Atom 1: QE TYR 75, Atom 2: HB3 SER 78
 &rst iat=-1, 1198, r3=8.000000, r4=8.500000, igr1=1165, 1170, &end
# Atom 1: QE TYR 75, Atom 2: H LEU 121
 &rst iat=-1, 1817, r3=8.000000, r4=8.500000, igr1=1165, 1170, &end
# Atom 1: QE TYR 75, Atom 2: H VAL 122
 &rst iat=-1, 1836, r3=8.000000, r4=8.500000, igr1=1165, 1170, &end
# Atom 1: QE TYR 75, Atom 2: QE LYS 123
 &rst iat=-1, -1, r3=8.880000, r4=9.380000, 
 igr1=1165, 1170, igr2=1865, 1866, &end
# Atom 1: H ALA 76, Atom 2: H GLY 77
 &rst iat=1176, 1186, r3=4.600000, r4=5.100000, &end
# Atom 1: H ALA 76, Atom 2: QA GLY 77
 &rst iat=1176, -1, r3=6.880000, r4=7.380000, igr2=1188, 1189, &end
# Atom 1: H ALA 76, Atom 2: QND ASN 81
 &rst iat=1176, -1, r3=6.870000, r4=7.370000, igr2=1232, 1233, &end
# Atom 1: H ALA 76, Atom 2: QB GLU 83
 &rst iat=1176, -1, r3=6.280000, r4=6.780000, igr2=1260, 1261, &end
# Atom 1: H ALA 76, Atom 2: QG GLU 83
 &rst iat=1176, -1, r3=6.880000, r4=7.380000, igr2=1263, 1264, &end
# Atom 1: HA ALA 76, Atom 2: H GLY 77
 &rst iat=1178, 1186, r3=3.500000, r4=4.000000, &end
# Atom 1: HA ALA 76, Atom 2: HA2 GLY 77
 &rst iat=1178, 1188, r3=5.400000, r4=5.900000, &end
# Atom 1: HA ALA 76, Atom 2: HA3 GLY 77
 &rst iat=1178, 1189, r3=5.400000, r4=5.900000, &end
# Atom 1: HA ALA 76, Atom 2: QA GLY 77
 &rst iat=1178, -1, r3=5.130000, r4=5.630000, igr2=1188, 1189, &end
# Atom 1: HA ALA 76, Atom 2: H SER 78
 &rst iat=1178, 1193, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ALA 76, Atom 2: QND ASN 81
 &rst iat=1178, -1, r3=6.870000, r4=7.370000, igr2=1232, 1233, &end
# Atom 1: QB ALA 76, Atom 2: HA2 GLY 77
 &rst iat=-1, 1188, r3=5.700000, r4=6.200000, igr1=1180, 1181, 1182, &end
# Atom 1: QB ALA 76, Atom 2: HA3 GLY 77
 &rst iat=-1, 1189, r3=5.700000, r4=6.200000, igr1=1180, 1181, 1182, &end
# Atom 1: QB ALA 76, Atom 2: H SER 78
 &rst iat=-1, 1193, r3=6.000000, r4=6.500000, igr1=1180, 1181, 1182, &end
# Atom 1: QB ALA 76, Atom 2: H ASP 79
 &rst iat=-1, 1204, r3=6.500000, r4=7.000000, igr1=1180, 1181, 1182, &end
# Atom 1: QB ALA 76, Atom 2: HND1 ASN 81
 &rst iat=-1, 1232, r3=7.000000, r4=7.500000, igr1=1180, 1181, 1182, &end
# Atom 1: QB ALA 76, Atom 2: HND2 ASN 81
 &rst iat=-1, 1233, r3=7.000000, r4=7.500000, igr1=1180, 1181, 1182, &end
# Atom 1: H GLY 77, Atom 2: H SER 78
 &rst iat=1186, 1193, r3=4.700000, r4=5.200000, &end
# Atom 1: H GLY 77, Atom 2: QG2 ILE 82
 &rst iat=1186, -1, r3=7.000000, r4=7.500000, igr2=1243, 1244, 1245, &end
# Atom 1: H GLY 77, Atom 2: QD ILE 82
 &rst iat=1186, -1, r3=7.000000, r4=7.500000, igr2=1250, 1251, 1252, &end
# Atom 1: HA2 GLY 77, Atom 2: HA SER 78
 &rst iat=1188, 1195, r3=5.700000, r4=6.200000, &end
# Atom 1: HA2 GLY 77, Atom 2: QG2 ILE 82
 &rst iat=1188, -1, r3=6.900000, r4=7.400000, igr2=1243, 1244, 1245, &end
# Atom 1: HA2 GLY 77, Atom 2: QD ILE 82
 &rst iat=1188, -1, r3=7.000000, r4=7.500000, igr2=1250, 1251, 1252, &end
# Atom 1: HA3 GLY 77, Atom 2: HA SER 78
 &rst iat=1189, 1195, r3=5.700000, r4=6.200000, &end
# Atom 1: HA3 GLY 77, Atom 2: QG2 ILE 82
 &rst iat=1189, -1, r3=6.900000, r4=7.400000, igr2=1243, 1244, 1245, &end
# Atom 1: HA3 GLY 77, Atom 2: QD ILE 82
 &rst iat=1189, -1, r3=7.000000, r4=7.500000, igr2=1250, 1251, 1252, &end
# Atom 1: QA GLY 77, Atom 2: HA SER 78
 &rst iat=-1, 1195, r3=5.430000, r4=5.930000, igr1=1188, 1189, &end
# Atom 1: QA GLY 77, Atom 2: QG2 ILE 82
 &rst iat=-1, -1, r3=6.600000, r4=7.100000, 
 igr1=1188, 1189, igr2=1243, 1244, 1245, &end
# Atom 1: H SER 78, Atom 2: QB SER 78
 &rst iat=1193, -1, r3=3.910000, r4=4.410000, igr2=1197, 1198, &end
# Atom 1: H SER 78, Atom 2: H ASP 79
 &rst iat=1193, 1204, r3=4.900000, r4=5.400000, &end
# Atom 1: H SER 78, Atom 2: HA ASP 79
 &rst iat=1193, 1206, r3=5.400000, r4=5.900000, &end
# Atom 1: H SER 78, Atom 2: QB ASN 81
 &rst iat=1193, -1, r3=4.980000, r4=5.480000, igr2=1227, 1228, &end
# Atom 1: HB2 SER 78, Atom 2: H ASP 79
 &rst iat=1197, 1204, r3=4.500000, r4=5.000000, &end
# Atom 1: HB3 SER 78, Atom 2: H ASP 79
 &rst iat=1198, 1204, r3=4.500000, r4=5.000000, &end
# Atom 1: QB SER 78, Atom 2: H ASP 79
 &rst iat=-1, 1204, r3=4.210000, r4=4.710000, igr1=1197, 1198, &end
# Atom 1: QB SER 78, Atom 2: HA ASP 79
 &rst iat=-1, 1206, r3=6.880000, r4=7.380000, igr1=1197, 1198, &end
# Atom 1: H ASP 79, Atom 2: H GLY 80
 &rst iat=1204, 1216, r3=4.500000, r4=5.000000, &end
# Atom 1: H ASP 79, Atom 2: QA GLY 80
 &rst iat=1204, -1, r3=6.080000, r4=6.580000, igr2=1218, 1219, &end
# Atom 1: H ASP 79, Atom 2: H ASN 81
 &rst iat=1204, 1223, r3=5.100000, r4=5.600000, &end
# Atom 1: H ASP 79, Atom 2: QND ASN 81
 &rst iat=1204, -1, r3=6.870000, r4=7.370000, igr2=1232, 1233, &end
# Atom 1: H ASP 79, Atom 2: QE PHE 124
 &rst iat=1204, -1, r3=8.000000, r4=8.500000, igr2=1884, 1888, &end
# Atom 1: HA ASP 79, Atom 2: HA2 GLY 80
 &rst iat=1206, 1218, r3=5.700000, r4=6.200000, &end
# Atom 1: HA ASP 79, Atom 2: HA3 GLY 80
 &rst iat=1206, 1219, r3=5.700000, r4=6.200000, &end
# Atom 1: HA ASP 79, Atom 2: H ASN 81
 &rst iat=1206, 1223, r3=5.700000, r4=6.200000, &end
# Atom 1: HA ASP 79, Atom 2: HD2 PRO 126
 &rst iat=1206, 1907, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ASP 79, Atom 2: HD3 PRO 126
 &rst iat=1206, 1908, r3=6.000000, r4=6.500000, &end
# Atom 1: QB ASP 79, Atom 2: QA GLY 80
 &rst iat=-1, -1, r3=7.880000, r4=8.380000, 
 igr1=1208, 1209, igr2=1218, 1219, &end
# Atom 1: QB ASP 79, Atom 2: H ASN 81
 &rst iat=-1, 1223, r3=5.000000, r4=5.500000, igr1=1208, 1209, &end
# Atom 1: QB ASP 79, Atom 2: QG PRO 126
 &rst iat=-1, -1, r3=7.880000, r4=8.380000, 
 igr1=1208, 1209, igr2=1910, 1911, &end
# Atom 1: QB ASP 79, Atom 2: HD2 PRO 126
 &rst iat=-1, 1907, r3=7.000000, r4=7.500000, igr1=1208, 1209, &end
# Atom 1: QB ASP 79, Atom 2: HD3 PRO 126
 &rst iat=-1, 1908, r3=7.000000, r4=7.500000, igr1=1208, 1209, &end
# Atom 1: H GLY 80, Atom 2: H ASN 81
 &rst iat=1216, 1223, r3=3.700000, r4=4.200000, &end
# Atom 1: H GLY 80, Atom 2: HA ASN 81
 &rst iat=1216, 1225, r3=5.000000, r4=5.500000, &end
# Atom 1: H GLY 80, Atom 2: H PHE 124
 &rst iat=1216, 1874, r3=4.700000, r4=5.200000, &end
# Atom 1: H GLY 80, Atom 2: QD PHE 124
 &rst iat=1216, -1, r3=8.000000, r4=8.500000, igr2=1882, 1890, &end
# Atom 1: H GLY 80, Atom 2: QE PHE 124
 &rst iat=1216, -1, r3=8.000000, r4=8.500000, igr2=1884, 1888, &end
# Atom 1: H GLY 80, Atom 2: HA ASP 125
 &rst iat=1216, 1896, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 80, Atom 2: HB2 PRO 126
 &rst iat=1216, 1913, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 80, Atom 2: HB3 PRO 126
 &rst iat=1216, 1914, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 80, Atom 2: HG2 PRO 126
 &rst iat=1216, 1910, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 80, Atom 2: HG3 PRO 126
 &rst iat=1216, 1911, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 80, Atom 2: QG PRO 126
 &rst iat=1216, -1, r3=5.550000, r4=6.050000, igr2=1910, 1911, &end
# Atom 1: H GLY 80, Atom 2: HD2 PRO 126
 &rst iat=1216, 1907, r3=5.900000, r4=6.400000, &end
# Atom 1: H GLY 80, Atom 2: HD3 PRO 126
 &rst iat=1216, 1908, r3=5.900000, r4=6.400000, &end
# Atom 1: H GLY 80, Atom 2: QD PRO 126
 &rst iat=1216, -1, r3=5.730000, r4=6.230000, igr2=1907, 1908, &end
# Atom 1: HA2 GLY 80, Atom 2: HA ASN 81
 &rst iat=1218, 1225, r3=5.000000, r4=5.500000, &end
# Atom 1: HA2 GLY 80, Atom 2: H PHE 124
 &rst iat=1218, 1874, r3=5.700000, r4=6.200000, &end
# Atom 1: HA2 GLY 80, Atom 2: QD PHE 124
 &rst iat=1218, -1, r3=8.000000, r4=8.500000, igr2=1882, 1890, &end
# Atom 1: HA2 GLY 80, Atom 2: QE PHE 124
 &rst iat=1218, -1, r3=8.000000, r4=8.500000, igr2=1884, 1888, &end
# Atom 1: HA2 GLY 80, Atom 2: HG2 PRO 126
 &rst iat=1218, 1910, r3=7.750000, r4=8.250000, &end
# Atom 1: HA2 GLY 80, Atom 2: HG3 PRO 126
 &rst iat=1218, 1911, r3=7.750000, r4=8.250000, &end
# Atom 1: HA2 GLY 80, Atom 2: HD2 PRO 126
 &rst iat=1218, 1907, r3=6.000000, r4=6.500000, &end
# Atom 1: HA2 GLY 80, Atom 2: HD3 PRO 126
 &rst iat=1218, 1908, r3=6.000000, r4=6.500000, &end
# Atom 1: HA3 GLY 80, Atom 2: HA ASN 81
 &rst iat=1219, 1225, r3=5.000000, r4=5.500000, &end
# Atom 1: HA3 GLY 80, Atom 2: H PHE 124
 &rst iat=1219, 1874, r3=5.700000, r4=6.200000, &end
# Atom 1: HA3 GLY 80, Atom 2: QD PHE 124
 &rst iat=1219, -1, r3=8.000000, r4=8.500000, igr2=1882, 1890, &end
# Atom 1: HA3 GLY 80, Atom 2: QE PHE 124
 &rst iat=1219, -1, r3=8.000000, r4=8.500000, igr2=1884, 1888, &end
# Atom 1: HA3 GLY 80, Atom 2: HG2 PRO 126
 &rst iat=1219, 1910, r3=7.750000, r4=8.250000, &end
# Atom 1: HA3 GLY 80, Atom 2: HG3 PRO 126
 &rst iat=1219, 1911, r3=7.750000, r4=8.250000, &end
# Atom 1: HA3 GLY 80, Atom 2: HD2 PRO 126
 &rst iat=1219, 1907, r3=6.000000, r4=6.500000, &end
# Atom 1: HA3 GLY 80, Atom 2: HD3 PRO 126
 &rst iat=1219, 1908, r3=6.000000, r4=6.500000, &end
# Atom 1: QA GLY 80, Atom 2: HA ASN 81
 &rst iat=-1, 1225, r3=4.680000, r4=5.180000, igr1=1218, 1219, &end
# Atom 1: QA GLY 80, Atom 2: QND ASN 81
 &rst iat=-1, -1, r3=7.740000, r4=8.240000, 
 igr1=1218, 1219, igr2=1232, 1233, &end
# Atom 1: QA GLY 80, Atom 2: HA LYS 123
 &rst iat=-1, 1854, r3=6.880000, r4=7.380000, igr1=1218, 1219, &end
# Atom 1: QA GLY 80, Atom 2: H PHE 124
 &rst iat=-1, 1874, r3=5.290000, r4=5.790000, igr1=1218, 1219, &end
# Atom 1: QA GLY 80, Atom 2: QB PRO 126
 &rst iat=-1, -1, r3=7.750000, r4=8.250000, 
 igr1=1218, 1219, igr2=1913, 1914, &end
# Atom 1: QA GLY 80, Atom 2: QG PRO 126
 &rst iat=-1, -1, r3=6.820000, r4=7.320000, 
 igr1=1218, 1219, igr2=1910, 1911, &end
# Atom 1: H ASN 81, Atom 2: HB2 ASN 81
 &rst iat=1223, 1227, r3=3.800000, r4=4.300000, &end
# Atom 1: H ASN 81, Atom 2: HB3 ASN 81
 &rst iat=1223, 1228, r3=3.800000, r4=4.300000, &end
# Atom 1: H ASN 81, Atom 2: QB ASN 81
 &rst iat=1223, -1, r3=3.600000, r4=4.100000, igr2=1227, 1228, &end
# Atom 1: H ASN 81, Atom 2: HND1 ASN 81
 &rst iat=1223, 1232, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASN 81, Atom 2: HND2 ASN 81
 &rst iat=1223, 1233, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASN 81, Atom 2: QND ASN 81
 &rst iat=1223, -1, r3=5.590000, r4=6.090000, igr2=1232, 1233, &end
# Atom 1: H ASN 81, Atom 2: H ILE 82
 &rst iat=1223, 1237, r3=4.500000, r4=5.000000, &end
# Atom 1: H ASN 81, Atom 2: QG2 ILE 82
 &rst iat=1223, -1, r3=6.000000, r4=6.500000, igr2=1243, 1244, 1245, &end
# Atom 1: H ASN 81, Atom 2: QG1 ILE 82
 &rst iat=1223, -1, r3=6.880000, r4=7.380000, igr2=1247, 1248, &end
# Atom 1: H ASN 81, Atom 2: QD ILE 82
 &rst iat=1223, -1, r3=6.900000, r4=7.400000, igr2=1250, 1251, 1252, &end
# Atom 1: H ASN 81, Atom 2: H PHE 124
 &rst iat=1223, 1874, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASN 81, Atom 2: QD PHE 124
 &rst iat=1223, -1, r3=8.000000, r4=8.500000, igr2=1882, 1890, &end
# Atom 1: H ASN 81, Atom 2: QE PHE 124
 &rst iat=1223, -1, r3=8.000000, r4=8.500000, igr2=1884, 1888, &end
# Atom 1: H ASN 81, Atom 2: QD PRO 126
 &rst iat=1223, -1, r3=6.880000, r4=7.380000, igr2=1907, 1908, &end
# Atom 1: HA ASN 81, Atom 2: HND1 ASN 81
 &rst iat=1225, 1232, r3=5.800000, r4=6.300000, &end
# Atom 1: HA ASN 81, Atom 2: HND2 ASN 81
 &rst iat=1225, 1233, r3=5.800000, r4=6.300000, &end
# Atom 1: HA ASN 81, Atom 2: H ILE 82
 &rst iat=1225, 1237, r3=3.100000, r4=3.600000, &end
# Atom 1: HA ASN 81, Atom 2: H VAL 122
 &rst iat=1225, 1836, r3=5.800000, r4=6.300000, &end
# Atom 1: HA ASN 81, Atom 2: HA LYS 123
 &rst iat=1225, 1854, r3=5.000000, r4=5.500000, &end
# Atom 1: HA ASN 81, Atom 2: QB LYS 123
 &rst iat=1225, -1, r3=7.000000, r4=7.500000, igr2=1856, 1857, &end
# Atom 1: HA ASN 81, Atom 2: HG2 LYS 123
 &rst iat=1225, 1859, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ASN 81, Atom 2: HG3 LYS 123
 &rst iat=1225, 1860, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ASN 81, Atom 2: HD2 LYS 123
 &rst iat=1225, 1862, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ASN 81, Atom 2: HD3 LYS 123
 &rst iat=1225, 1863, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ASN 81, Atom 2: H PHE 124
 &rst iat=1225, 1874, r3=4.500000, r4=5.000000, &end
# Atom 1: HA ASN 81, Atom 2: QD PHE 124
 &rst iat=1225, -1, r3=8.000000, r4=8.500000, igr2=1882, 1890, &end
# Atom 1: HA ASN 81, Atom 2: QE PHE 124
 &rst iat=1225, -1, r3=8.000000, r4=8.500000, igr2=1884, 1888, &end
# Atom 1: HB2 ASN 81, Atom 2: H ILE 82
 &rst iat=1227, 1237, r3=4.700000, r4=5.200000, &end
# Atom 1: HB3 ASN 81, Atom 2: H ILE 82
 &rst iat=1228, 1237, r3=4.700000, r4=5.200000, &end
# Atom 1: HND1 ASN 81, Atom 2: HB2 GLU 83
 &rst iat=1232, 1260, r3=7.750000, r4=8.250000, &end
# Atom 1: HND1 ASN 81, Atom 2: HB3 GLU 83
 &rst iat=1232, 1261, r3=7.750000, r4=8.250000, &end
# Atom 1: HND1 ASN 81, Atom 2: HG2 GLU 83
 &rst iat=1232, 1263, r3=7.730000, r4=8.230000, &end
# Atom 1: HND1 ASN 81, Atom 2: HG3 GLU 83
 &rst iat=1232, 1264, r3=7.730000, r4=8.230000, &end
# Atom 1: HND1 ASN 81, Atom 2: QD1 LEU 121
 &rst iat=1232, -1, r3=8.640000, r4=9.140000, igr2=1826, 1827, 1828, &end
# Atom 1: HND1 ASN 81, Atom 2: QD2 LEU 121
 &rst iat=1232, -1, r3=8.640000, r4=9.140000, igr2=1830, 1831, 1832, &end
# Atom 1: HND1 ASN 81, Atom 2: HG2 LYS 123
 &rst iat=1232, 1859, r3=7.750000, r4=8.250000, &end
# Atom 1: HND1 ASN 81, Atom 2: HG3 LYS 123
 &rst iat=1232, 1860, r3=7.750000, r4=8.250000, &end
# Atom 1: HND1 ASN 81, Atom 2: HD2 LYS 123
 &rst iat=1232, 1862, r3=6.000000, r4=6.500000, &end
# Atom 1: HND1 ASN 81, Atom 2: HD3 LYS 123
 &rst iat=1232, 1863, r3=6.000000, r4=6.500000, &end
# Atom 1: HND2 ASN 81, Atom 2: HB2 GLU 83
 &rst iat=1233, 1260, r3=7.750000, r4=8.250000, &end
# Atom 1: HND2 ASN 81, Atom 2: HB3 GLU 83
 &rst iat=1233, 1261, r3=7.750000, r4=8.250000, &end
# Atom 1: HND2 ASN 81, Atom 2: HG2 GLU 83
 &rst iat=1233, 1263, r3=7.730000, r4=8.230000, &end
# Atom 1: HND2 ASN 81, Atom 2: HG3 GLU 83
 &rst iat=1233, 1264, r3=7.730000, r4=8.230000, &end
# Atom 1: HND2 ASN 81, Atom 2: QD1 LEU 121
 &rst iat=1233, -1, r3=8.640000, r4=9.140000, igr2=1826, 1827, 1828, &end
# Atom 1: HND2 ASN 81, Atom 2: QD2 LEU 121
 &rst iat=1233, -1, r3=8.640000, r4=9.140000, igr2=1830, 1831, 1832, &end
# Atom 1: HND2 ASN 81, Atom 2: HG2 LYS 123
 &rst iat=1233, 1859, r3=7.750000, r4=8.250000, &end
# Atom 1: HND2 ASN 81, Atom 2: HG3 LYS 123
 &rst iat=1233, 1860, r3=7.750000, r4=8.250000, &end
# Atom 1: HND2 ASN 81, Atom 2: HD2 LYS 123
 &rst iat=1233, 1862, r3=6.000000, r4=6.500000, &end
# Atom 1: HND2 ASN 81, Atom 2: HD3 LYS 123
 &rst iat=1233, 1863, r3=6.000000, r4=6.500000, &end
# Atom 1: QND ASN 81, Atom 2: H ILE 82
 &rst iat=-1, 1237, r3=6.870000, r4=7.370000, igr1=1232, 1233, &end
# Atom 1: QND ASN 81, Atom 2: QB GLU 83
 &rst iat=-1, -1, r3=6.820000, r4=7.320000, 
 igr1=1232, 1233, igr2=1260, 1261, &end
# Atom 1: QND ASN 81, Atom 2: QG GLU 83
 &rst iat=-1, -1, r3=6.330000, r4=6.830000, 
 igr1=1232, 1233, igr2=1263, 1264, &end
# Atom 1: QND ASN 81, Atom 2: QQD LEU 121
 &rst iat=-1, -1, r3=7.020000, r4=7.520000, 
 igr1=1232, 1233, igr2=1826, 1827, 1828, 1830, 1831, 1832, &end
# Atom 1: QND ASN 81, Atom 2: QB LYS 123
 &rst iat=-1, -1, r3=7.870000, r4=8.370000, 
 igr1=1232, 1233, igr2=1856, 1857, &end
# Atom 1: QND ASN 81, Atom 2: QG LYS 123
 &rst iat=-1, -1, r3=6.620000, r4=7.120000, 
 igr1=1232, 1233, igr2=1859, 1860, &end
# Atom 1: QND ASN 81, Atom 2: QD LYS 123
 &rst iat=-1, -1, r3=5.700000, r4=6.200000, 
 igr1=1232, 1233, igr2=1862, 1863, &end
# Atom 1: H ILE 82, Atom 2: HB ILE 82
 &rst iat=1237, 1241, r3=3.900000, r4=4.400000, &end
# Atom 1: H ILE 82, Atom 2: QG2 ILE 82
 &rst iat=1237, -1, r3=4.700000, r4=5.200000, igr2=1243, 1244, 1245, &end
# Atom 1: H ILE 82, Atom 2: HG12 ILE 82
 &rst iat=1237, 1247, r3=4.100000, r4=4.600000, &end
# Atom 1: H ILE 82, Atom 2: HG13 ILE 82
 &rst iat=1237, 1248, r3=4.100000, r4=4.600000, &end
# Atom 1: H ILE 82, Atom 2: QD ILE 82
 &rst iat=1237, -1, r3=4.800000, r4=5.300000, igr2=1250, 1251, 1252, &end
# Atom 1: H ILE 82, Atom 2: H GLU 83
 &rst iat=1237, 1256, r3=5.000000, r4=5.500000, &end
# Atom 1: H ILE 82, Atom 2: QG GLU 83
 &rst iat=1237, -1, r3=6.880000, r4=7.380000, igr2=1263, 1264, &end
# Atom 1: H ILE 82, Atom 2: QQD LEU 84
 &rst iat=1237, -1, r3=8.570000, r4=9.070000, igr2=1280, 1281, 1282, 1284, 1285, 1286, &end
# Atom 1: H ILE 82, Atom 2: QD PHE 124
 &rst iat=1237, -1, r3=8.000000, r4=8.500000, igr2=1882, 1890, &end
# Atom 1: H ILE 82, Atom 2: QE PHE 124
 &rst iat=1237, -1, r3=7.900000, r4=8.400000, igr2=1884, 1888, &end
# Atom 1: HA ILE 82, Atom 2: H GLU 83
 &rst iat=1239, 1256, r3=3.100000, r4=3.600000, &end
# Atom 1: HA ILE 82, Atom 2: QG GLU 83
 &rst iat=1239, -1, r3=6.880000, r4=7.380000, igr2=1263, 1264, &end
# Atom 1: QG2 ILE 82, Atom 2: H GLU 83
 &rst iat=-1, 1256, r3=5.900000, r4=6.400000, igr1=1243, 1244, 1245, &end
# Atom 1: HG12 ILE 82, Atom 2: H GLU 83
 &rst iat=1247, 1256, r3=5.700000, r4=6.200000, &end
# Atom 1: HG13 ILE 82, Atom 2: H GLU 83
 &rst iat=1248, 1256, r3=5.700000, r4=6.200000, &end
# Atom 1: QG1 ILE 82, Atom 2: H GLU 83
 &rst iat=-1, 1256, r3=5.530000, r4=6.030000, igr1=1247, 1248, &end
# Atom 1: QD ILE 82, Atom 2: H GLU 83
 &rst iat=-1, 1256, r3=6.400000, r4=6.900000, igr1=1250, 1251, 1252, &end
# Atom 1: QD ILE 82, Atom 2: QG GLU 83
 &rst iat=-1, -1, r3=7.880000, r4=8.380000, 
 igr1=1250, 1251, 1252, igr2=1263, 1264, &end
# Atom 1: H GLU 83, Atom 2: HB2 GLU 83
 &rst iat=1256, 1260, r3=3.700000, r4=4.200000, &end
# Atom 1: H GLU 83, Atom 2: HB3 GLU 83
 &rst iat=1256, 1261, r3=3.700000, r4=4.200000, &end
# Atom 1: H GLU 83, Atom 2: HG2 GLU 83
 &rst iat=1256, 1263, r3=4.600000, r4=5.100000, &end
# Atom 1: H GLU 83, Atom 2: HG3 GLU 83
 &rst iat=1256, 1264, r3=4.600000, r4=5.100000, &end
# Atom 1: H GLU 83, Atom 2: QG GLU 83
 &rst iat=1256, -1, r3=4.130000, r4=4.630000, igr2=1263, 1264, &end
# Atom 1: H GLU 83, Atom 2: H LEU 84
 &rst iat=1256, 1271, r3=4.900000, r4=5.400000, &end
# Atom 1: H GLU 83, Atom 2: QQD LEU 84
 &rst iat=1256, -1, r3=8.570000, r4=9.070000, igr2=1280, 1281, 1282, 1284, 1285, 1286, &end
# Atom 1: H GLU 83, Atom 2: HA LEU 121
 &rst iat=1256, 1819, r3=5.800000, r4=6.300000, &end
# Atom 1: H GLU 83, Atom 2: QB LEU 121
 &rst iat=1256, -1, r3=6.880000, r4=7.380000, igr2=1821, 1822, &end
# Atom 1: H GLU 83, Atom 2: QQD LEU 121
 &rst iat=1256, -1, r3=7.770000, r4=8.270000, igr2=1826, 1827, 1828, 1830, 1831, 1832, &end
# Atom 1: H GLU 83, Atom 2: H VAL 122
 &rst iat=1256, 1836, r3=5.800000, r4=6.300000, &end
# Atom 1: H GLU 83, Atom 2: QE PHE 124
 &rst iat=1256, -1, r3=8.000000, r4=8.500000, igr2=1884, 1888, &end
# Atom 1: HA GLU 83, Atom 2: H LEU 84
 &rst iat=1258, 1271, r3=3.400000, r4=3.900000, &end
# Atom 1: HA GLU 83, Atom 2: HA LEU 121
 &rst iat=1258, 1819, r3=4.100000, r4=4.600000, &end
# Atom 1: HA GLU 83, Atom 2: H VAL 122
 &rst iat=1258, 1836, r3=5.200000, r4=5.700000, &end
# Atom 1: HA GLU 83, Atom 2: H ALA 148
 &rst iat=1258, 2261, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 GLU 83, Atom 2: H LEU 84
 &rst iat=1260, 1271, r3=4.900000, r4=5.400000, &end
# Atom 1: HB2 GLU 83, Atom 2: H ALA 120
 &rst iat=1260, 1807, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 GLU 83, Atom 2: H ALA 148
 &rst iat=1260, 2261, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 GLU 83, Atom 2: H LEU 84
 &rst iat=1261, 1271, r3=4.900000, r4=5.400000, &end
# Atom 1: HB3 GLU 83, Atom 2: H ALA 120
 &rst iat=1261, 1807, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 GLU 83, Atom 2: H ALA 148
 &rst iat=1261, 2261, r3=6.000000, r4=6.500000, &end
# Atom 1: QB GLU 83, Atom 2: H ALA 120
 &rst iat=-1, 1807, r3=5.690000, r4=6.190000, igr1=1260, 1261, &end
# Atom 1: QB GLU 83, Atom 2: QB ALA 148
 &rst iat=-1, -1, r3=6.480000, r4=6.980000, 
 igr1=1260, 1261, igr2=2265, 2266, 2267, &end
# Atom 1: HG2 GLU 83, Atom 2: H LEU 84
 &rst iat=1263, 1271, r3=5.900000, r4=6.400000, &end
# Atom 1: HG2 GLU 83, Atom 2: QB LYS 119
 &rst iat=1263, -1, r3=7.000000, r4=7.500000, igr2=1789, 1790, &end
# Atom 1: HG2 GLU 83, Atom 2: HA LEU 121
 &rst iat=1263, 1819, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 GLU 83, Atom 2: H ALA 148
 &rst iat=1263, 2261, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLU 83, Atom 2: H LEU 84
 &rst iat=1264, 1271, r3=5.900000, r4=6.400000, &end
# Atom 1: HG3 GLU 83, Atom 2: QB LYS 119
 &rst iat=1264, -1, r3=7.000000, r4=7.500000, igr2=1789, 1790, &end
# Atom 1: HG3 GLU 83, Atom 2: HA LEU 121
 &rst iat=1264, 1819, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLU 83, Atom 2: H ALA 148
 &rst iat=1264, 2261, r3=6.000000, r4=6.500000, &end
# Atom 1: QG GLU 83, Atom 2: H LEU 84
 &rst iat=-1, 1271, r3=5.680000, r4=6.180000, igr1=1263, 1264, &end
# Atom 1: QG GLU 83, Atom 2: QD LYS 119
 &rst iat=-1, -1, r3=7.750000, r4=8.250000, 
 igr1=1263, 1264, igr2=1795, 1796, &end
# Atom 1: QG GLU 83, Atom 2: QE LYS 119
 &rst iat=-1, -1, r3=7.880000, r4=8.380000, 
 igr1=1263, 1264, igr2=1798, 1799, &end
# Atom 1: QG GLU 83, Atom 2: H ALA 120
 &rst iat=-1, 1807, r3=6.880000, r4=7.380000, igr1=1263, 1264, &end
# Atom 1: QG GLU 83, Atom 2: QQD LEU 121
 &rst iat=-1, -1, r3=7.450000, r4=7.950000, 
 igr1=1263, 1264, igr2=1826, 1827, 1828, 1830, 1831, 1832, &end
# Atom 1: QG GLU 83, Atom 2: QB ALA 148
 &rst iat=-1, -1, r3=5.780000, r4=6.280000, 
 igr1=1263, 1264, igr2=2265, 2266, 2267, &end
# Atom 1: H LEU 84, Atom 2: HB2 LEU 84
 &rst iat=1271, 1275, r3=4.100000, r4=4.600000, &end
# Atom 1: H LEU 84, Atom 2: HB3 LEU 84
 &rst iat=1271, 1276, r3=4.100000, r4=4.600000, &end
# Atom 1: H LEU 84, Atom 2: QB LEU 84
 &rst iat=1271, -1, r3=3.900000, r4=4.400000, igr2=1275, 1276, &end
# Atom 1: H LEU 84, Atom 2: HG LEU 84
 &rst iat=1271, 1278, r3=4.900000, r4=5.400000, &end
# Atom 1: H LEU 84, Atom 2: QD1 LEU 84
 &rst iat=1271, -1, r3=5.400000, r4=5.900000, igr2=1280, 1281, 1282, &end
# Atom 1: H LEU 84, Atom 2: QD2 LEU 84
 &rst iat=1271, -1, r3=5.400000, r4=5.900000, igr2=1284, 1285, 1286, &end
# Atom 1: H LEU 84, Atom 2: QQD LEU 84
 &rst iat=1271, -1, r3=5.010000, r4=5.510000, igr2=1280, 1281, 1282, 1284, 1285, 1286, &end
# Atom 1: H LEU 84, Atom 2: H THR 85
 &rst iat=1271, 1290, r3=4.600000, r4=5.100000, &end
# Atom 1: H LEU 84, Atom 2: HA THR 85
 &rst iat=1271, 1292, r3=4.900000, r4=5.400000, &end
# Atom 1: H LEU 84, Atom 2: HA LEU 121
 &rst iat=1271, 1819, r3=4.400000, r4=4.900000, &end
# Atom 1: H LEU 84, Atom 2: QB LEU 121
 &rst iat=1271, -1, r3=6.480000, r4=6.980000, igr2=1821, 1822, &end
# Atom 1: H LEU 84, Atom 2: QD1 LEU 121
 &rst iat=1271, -1, r3=6.900000, r4=7.400000, igr2=1826, 1827, 1828, &end
# Atom 1: H LEU 84, Atom 2: QD2 LEU 121
 &rst iat=1271, -1, r3=6.900000, r4=7.400000, igr2=1830, 1831, 1832, &end
# Atom 1: H LEU 84, Atom 2: QQD LEU 121
 &rst iat=1271, -1, r3=6.220000, r4=6.720000, igr2=1826, 1827, 1828, 1830, 1831, 1832, &end
# Atom 1: H LEU 84, Atom 2: H VAL 122
 &rst iat=1271, 1836, r3=5.300000, r4=5.800000, &end
# Atom 1: H LEU 84, Atom 2: QQG VAL 122
 &rst iat=1271, -1, r3=7.260000, r4=7.760000, igr2=1842, 1843, 1844, 1846, 1847, 1848, &end
# Atom 1: H LEU 84, Atom 2: H ALA 148
 &rst iat=1271, 2261, r3=6.000000, r4=6.500000, &end
# Atom 1: HA LEU 84, Atom 2: H THR 85
 &rst iat=1273, 1290, r3=3.600000, r4=4.100000, &end
# Atom 1: HA LEU 84, Atom 2: H ALA 120
 &rst iat=1273, 1807, r3=5.800000, r4=6.300000, &end
# Atom 1: HA LEU 84, Atom 2: H SER 146
 &rst iat=1273, 2231, r3=5.600000, r4=6.100000, &end
# Atom 1: HA LEU 84, Atom 2: H ALA 148
 &rst iat=1273, 2261, r3=4.500000, r4=5.000000, &end
# Atom 1: HB2 LEU 84, Atom 2: H THR 85
 &rst iat=1275, 1290, r3=4.300000, r4=4.800000, &end
# Atom 1: HB2 LEU 84, Atom 2: H SER 146
 &rst iat=1275, 2231, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 LEU 84, Atom 2: H ALA 148
 &rst iat=1275, 2261, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 LEU 84, Atom 2: H THR 85
 &rst iat=1276, 1290, r3=4.300000, r4=4.800000, &end
# Atom 1: HB3 LEU 84, Atom 2: H SER 146
 &rst iat=1276, 2231, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 LEU 84, Atom 2: H ALA 148
 &rst iat=1276, 2261, r3=6.000000, r4=6.500000, &end
# Atom 1: QB LEU 84, Atom 2: H THR 85
 &rst iat=-1, 1290, r3=3.870000, r4=4.370000, igr1=1275, 1276, &end
# Atom 1: QB LEU 84, Atom 2: H ALA 120
 &rst iat=-1, 1807, r3=6.380000, r4=6.880000, igr1=1275, 1276, &end
# Atom 1: QB LEU 84, Atom 2: H SER 146
 &rst iat=-1, 2231, r3=5.790000, r4=6.290000, igr1=1275, 1276, &end
# Atom 1: QB LEU 84, Atom 2: H LEU 147
 &rst iat=-1, 2242, r3=6.780000, r4=7.280000, igr1=1275, 1276, &end
# Atom 1: QB LEU 84, Atom 2: H ALA 148
 &rst iat=-1, 2261, r3=5.740000, r4=6.240000, igr1=1275, 1276, &end
# Atom 1: HG LEU 84, Atom 2: H VAL 122
 &rst iat=1278, 1836, r3=6.000000, r4=6.500000, &end
# Atom 1: HG LEU 84, Atom 2: H ALA 148
 &rst iat=1278, 2261, r3=6.000000, r4=6.500000, &end
# Atom 1: QD1 LEU 84, Atom 2: H THR 85
 &rst iat=-1, 1290, r3=6.000000, r4=6.500000, igr1=1280, 1281, 1282, &end
# Atom 1: QD1 LEU 84, Atom 2: H SER 146
 &rst iat=-1, 2231, r3=6.900000, r4=7.400000, igr1=1280, 1281, 1282, &end
# Atom 1: QD1 LEU 84, Atom 2: H LEU 147
 &rst iat=-1, 2242, r3=7.000000, r4=7.500000, igr1=1280, 1281, 1282, &end
# Atom 1: QD1 LEU 84, Atom 2: H ALA 148
 &rst iat=-1, 2261, r3=7.000000, r4=7.500000, igr1=1280, 1281, 1282, &end
# Atom 1: QD2 LEU 84, Atom 2: H THR 85
 &rst iat=-1, 1290, r3=6.000000, r4=6.500000, igr1=1284, 1285, 1286, &end
# Atom 1: QD2 LEU 84, Atom 2: H SER 146
 &rst iat=-1, 2231, r3=6.900000, r4=7.400000, igr1=1284, 1285, 1286, &end
# Atom 1: QD2 LEU 84, Atom 2: H LEU 147
 &rst iat=-1, 2242, r3=7.000000, r4=7.500000, igr1=1284, 1285, 1286, &end
# Atom 1: QD2 LEU 84, Atom 2: H ALA 148
 &rst iat=-1, 2261, r3=7.000000, r4=7.500000, igr1=1284, 1285, 1286, &end
# Atom 1: QQD LEU 84, Atom 2: H ALA 120
 &rst iat=-1, 1807, r3=8.570000, r4=9.070000, igr1=1280, 1281, 1282, 1284, 1285, 1286, &end
# Atom 1: QQD LEU 84, Atom 2: H LEU 121
 &rst iat=-1, 1817, r3=8.570000, r4=9.070000, igr1=1280, 1281, 1282, 1284, 1285, 1286, &end
# Atom 1: QQD LEU 84, Atom 2: H VAL 122
 &rst iat=-1, 1836, r3=8.570000, r4=9.070000, igr1=1280, 1281, 1282, 1284, 1285, 1286, &end
# Atom 1: QQD LEU 84, Atom 2: H SER 146
 &rst iat=-1, 2231, r3=6.220000, r4=6.720000, igr1=1280, 1281, 1282, 1284, 1285, 1286, &end
# Atom 1: QQD LEU 84, Atom 2: H LEU 147
 &rst iat=-1, 2242, r3=6.280000, r4=6.780000, igr1=1280, 1281, 1282, 1284, 1285, 1286, &end
# Atom 1: QQD LEU 84, Atom 2: H ALA 148
 &rst iat=-1, 2261, r3=6.280000, r4=6.780000, igr1=1280, 1281, 1282, 1284, 1285, 1286, &end
# Atom 1: QQD LEU 84, Atom 2: H GLN 149
 &rst iat=-1, 2271, r3=8.570000, r4=9.070000, igr1=1280, 1281, 1282, 1284, 1285, 1286, &end
# Atom 1: H THR 85, Atom 2: HB THR 85
 &rst iat=1290, 1294, r3=3.600000, r4=4.100000, &end
# Atom 1: H THR 85, Atom 2: QG THR 85
 &rst iat=1290, 1300, r3=4.500000, r4=5.000000, &end
# Atom 1: H THR 85, Atom 2: H ILE 86
 &rst iat=1290, 1304, r3=4.800000, r4=5.300000, &end
# Atom 1: H THR 85, Atom 2: H ALA 120
 &rst iat=1290, 1807, r3=5.500000, r4=6.000000, &end
# Atom 1: H THR 85, Atom 2: HA ALA 145
 &rst iat=1290, 2223, r3=5.800000, r4=6.300000, &end
# Atom 1: H THR 85, Atom 2: QB ALA 145
 &rst iat=1290, -1, r3=5.400000, r4=5.900000, igr2=2225, 2226, 2227, &end
# Atom 1: H THR 85, Atom 2: H SER 146
 &rst iat=1290, 2231, r3=4.600000, r4=5.100000, &end
# Atom 1: H THR 85, Atom 2: QB SER 146
 &rst iat=1290, -1, r3=7.000000, r4=7.500000, igr2=2235, 2236, &end
# Atom 1: H THR 85, Atom 2: H LEU 147
 &rst iat=1290, 2242, r3=6.000000, r4=6.500000, &end
# Atom 1: H THR 85, Atom 2: HA LEU 147
 &rst iat=1290, 2244, r3=4.900000, r4=5.400000, &end
# Atom 1: H THR 85, Atom 2: HB2 LEU 147
 &rst iat=1290, 2246, r3=6.000000, r4=6.500000, &end
# Atom 1: H THR 85, Atom 2: HB3 LEU 147
 &rst iat=1290, 2247, r3=6.000000, r4=6.500000, &end
# Atom 1: H THR 85, Atom 2: QQD LEU 147
 &rst iat=1290, -1, r3=7.570000, r4=8.070000, igr2=2251, 2252, 2253, 2255, 2256, 2257, &end
# Atom 1: H THR 85, Atom 2: H ALA 148
 &rst iat=1290, 2261, r3=5.100000, r4=5.600000, &end
# Atom 1: HA THR 85, Atom 2: H ILE 86
 &rst iat=1292, 1304, r3=3.400000, r4=3.900000, &end
# Atom 1: HA THR 85, Atom 2: H LYS 119
 &rst iat=1292, 1785, r3=6.000000, r4=6.500000, &end
# Atom 1: HA THR 85, Atom 2: H ALA 120
 &rst iat=1292, 1807, r3=5.000000, r4=5.500000, &end
# Atom 1: HA THR 85, Atom 2: H SER 146
 &rst iat=1292, 2231, r3=6.000000, r4=6.500000, &end
# Atom 1: HB THR 85, Atom 2: H ILE 86
 &rst iat=1294, 1304, r3=4.800000, r4=5.300000, &end
# Atom 1: HB THR 85, Atom 2: H SER 146
 &rst iat=1294, 2231, r3=5.900000, r4=6.400000, &end
# Atom 1: HB THR 85, Atom 2: H LEU 147
 &rst iat=1294, 2242, r3=6.000000, r4=6.500000, &end
# Atom 1: HB THR 85, Atom 2: H ALA 148
 &rst iat=1294, 2261, r3=6.000000, r4=6.500000, &end
# Atom 1: HB THR 85, Atom 2: H GLN 149
 &rst iat=1294, 2271, r3=6.000000, r4=6.500000, &end
# Atom 1: QG THR 85, Atom 2: H ILE 86
 &rst iat=1300, 1304, r3=5.700000, r4=6.200000, &end
# Atom 1: QG THR 85, Atom 2: H SER 146
 &rst iat=1300, 2231, r3=6.400000, r4=6.900000, &end
# Atom 1: H ILE 86, Atom 2: HB ILE 86
 &rst iat=1304, 1308, r3=3.800000, r4=4.300000, &end
# Atom 1: H ILE 86, Atom 2: HG12 ILE 86
 &rst iat=1304, 1314, r3=4.500000, r4=5.000000, &end
# Atom 1: H ILE 86, Atom 2: HG13 ILE 86
 &rst iat=1304, 1315, r3=4.500000, r4=5.000000, &end
# Atom 1: H ILE 86, Atom 2: QG1 ILE 86
 &rst iat=1304, -1, r3=4.210000, r4=4.710000, igr2=1314, 1315, &end
# Atom 1: H ILE 86, Atom 2: QD ILE 86
 &rst iat=1304, -1, r3=5.400000, r4=5.900000, igr2=1317, 1318, 1319, &end
# Atom 1: H ILE 86, Atom 2: H THR 87
 &rst iat=1304, 1323, r3=5.700000, r4=6.200000, &end
# Atom 1: H ILE 86, Atom 2: HA THR 87
 &rst iat=1304, 1325, r3=5.400000, r4=5.900000, &end
# Atom 1: H ILE 86, Atom 2: QE MET 89
 &rst iat=1304, -1, r3=7.000000, r4=7.500000, igr2=1357, 1358, 1359, &end
# Atom 1: H ILE 86, Atom 2: HA SER 118
 &rst iat=1304, 1776, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 86, Atom 2: HB2 SER 118
 &rst iat=1304, 1778, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 86, Atom 2: HB3 SER 118
 &rst iat=1304, 1779, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 86, Atom 2: H LYS 119
 &rst iat=1304, 1785, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 86, Atom 2: HA LYS 119
 &rst iat=1304, 1787, r3=4.800000, r4=5.300000, &end
# Atom 1: H ILE 86, Atom 2: H ALA 120
 &rst iat=1304, 1807, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 86, Atom 2: HA ALA 145
 &rst iat=1304, 2223, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ILE 86, Atom 2: H THR 87
 &rst iat=1306, 1323, r3=3.200000, r4=3.700000, &end
# Atom 1: HA ILE 86, Atom 2: H SER 146
 &rst iat=1306, 2231, r3=5.100000, r4=5.600000, &end
# Atom 1: HB ILE 86, Atom 2: H THR 87
 &rst iat=1308, 1323, r3=4.800000, r4=5.300000, &end
# Atom 1: HB ILE 86, Atom 2: H MET 89
 &rst iat=1308, 1344, r3=4.900000, r4=5.400000, &end
# Atom 1: QG2 ILE 86, Atom 2: H THR 87
 &rst iat=-1, 1323, r3=5.700000, r4=6.200000, igr1=1310, 1311, 1312, &end
# Atom 1: QG2 ILE 86, Atom 2: H MET 89
 &rst iat=-1, 1344, r3=6.600000, r4=7.100000, igr1=1310, 1311, 1312, &end
# Atom 1: QG2 ILE 86, Atom 2: H HID 144
 &rst iat=-1, 2204, r3=6.300000, r4=6.800000, igr1=1310, 1311, 1312, &end
# Atom 1: QG2 ILE 86, Atom 2: H ALA 145
 &rst iat=-1, 2221, r3=7.000000, r4=7.500000, igr1=1310, 1311, 1312, &end
# Atom 1: QG2 ILE 86, Atom 2: H SER 146
 &rst iat=-1, 2231, r3=6.900000, r4=7.400000, igr1=1310, 1311, 1312, &end
# Atom 1: QG1 ILE 86, Atom 2: H THR 87
 &rst iat=-1, 1323, r3=6.880000, r4=7.380000, igr1=1314, 1315, &end
# Atom 1: QG1 ILE 86, Atom 2: H MET 89
 &rst iat=-1, 1344, r3=6.680000, r4=7.180000, igr1=1314, 1315, &end
# Atom 1: QG1 ILE 86, Atom 2: H HID 144
 &rst iat=-1, 2204, r3=6.880000, r4=7.380000, igr1=1314, 1315, &end
# Atom 1: QG1 ILE 86, Atom 2: H SER 146
 &rst iat=-1, 2231, r3=6.880000, r4=7.380000, igr1=1314, 1315, &end
# Atom 1: QD ILE 86, Atom 2: H THR 87
 &rst iat=-1, 1323, r3=6.100000, r4=6.600000, igr1=1317, 1318, 1319, &end
# Atom 1: QD ILE 86, Atom 2: H MET 89
 &rst iat=-1, 1344, r3=5.600000, r4=6.100000, igr1=1317, 1318, 1319, &end
# Atom 1: QD ILE 86, Atom 2: H ALA 120
 &rst iat=-1, 1807, r3=6.200000, r4=6.700000, igr1=1317, 1318, 1319, &end
# Atom 1: H THR 87, Atom 2: HB THR 87
 &rst iat=1323, 1327, r3=4.200000, r4=4.700000, &end
# Atom 1: H THR 87, Atom 2: QG THR 87
 &rst iat=1323, 1333, r3=4.700000, r4=5.200000, &end
# Atom 1: H THR 87, Atom 2: H GLY 88
 &rst iat=1323, 1337, r3=5.100000, r4=5.600000, &end
# Atom 1: H THR 87, Atom 2: QA GLY 88
 &rst iat=1323, -1, r3=6.880000, r4=7.380000, igr2=1339, 1340, &end
# Atom 1: H THR 87, Atom 2: H MET 89
 &rst iat=1323, 1344, r3=5.100000, r4=5.600000, &end
# Atom 1: H THR 87, Atom 2: QB MET 89
 &rst iat=1323, -1, r3=6.880000, r4=7.380000, igr2=1348, 1349, &end
# Atom 1: H THR 87, Atom 2: QE MET 89
 &rst iat=1323, -1, r3=7.000000, r4=7.500000, igr2=1357, 1358, 1359, &end
# Atom 1: H THR 87, Atom 2: HB2 PHE 143
 &rst iat=1323, 2188, r3=6.000000, r4=6.500000, &end
# Atom 1: H THR 87, Atom 2: HB3 PHE 143
 &rst iat=1323, 2189, r3=6.000000, r4=6.500000, &end
# Atom 1: H THR 87, Atom 2: QD PHE 143
 &rst iat=1323, -1, r3=8.000000, r4=8.500000, igr2=2192, 2200, &end
# Atom 1: H THR 87, Atom 2: H HID 144
 &rst iat=1323, 2204, r3=5.100000, r4=5.600000, &end
# Atom 1: H THR 87, Atom 2: HB2 HID 144
 &rst iat=1323, 2208, r3=5.700000, r4=6.200000, &end
# Atom 1: H THR 87, Atom 2: HB3 HID 144
 &rst iat=1323, 2209, r3=5.700000, r4=6.200000, &end
# Atom 1: H THR 87, Atom 2: QB HID 144
 &rst iat=1323, -1, r3=5.480000, r4=5.980000, igr2=2208, 2209, &end
# Atom 1: H THR 87, Atom 2: H ALA 145
 &rst iat=1323, 2221, r3=6.000000, r4=6.500000, &end
# Atom 1: H THR 87, Atom 2: HA ALA 145
 &rst iat=1323, 2223, r3=5.100000, r4=5.600000, &end
# Atom 1: H THR 87, Atom 2: H SER 146
 &rst iat=1323, 2231, r3=5.000000, r4=5.500000, &end
# Atom 1: HB THR 87, Atom 2: H GLY 88
 &rst iat=1327, 1337, r3=4.600000, r4=5.100000, &end
# Atom 1: HB THR 87, Atom 2: H MET 89
 &rst iat=1327, 1344, r3=6.000000, r4=6.500000, &end
# Atom 1: HB THR 87, Atom 2: H HID 144
 &rst iat=1327, 2204, r3=6.000000, r4=6.500000, &end
# Atom 1: QG THR 87, Atom 2: H GLY 88
 &rst iat=1333, 1337, r3=6.900000, r4=7.400000, &end
# Atom 1: QG THR 87, Atom 2: H MET 89
 &rst iat=1333, 1344, r3=7.000000, r4=7.500000, &end
# Atom 1: QG THR 87, Atom 2: H HID 144
 &rst iat=1333, 2204, r3=7.000000, r4=7.500000, &end
# Atom 1: H GLY 88, Atom 2: H MET 89
 &rst iat=1337, 1344, r3=4.600000, r4=5.100000, &end
# Atom 1: H GLY 88, Atom 2: QD PHE 143
 &rst iat=1337, -1, r3=8.000000, r4=8.500000, igr2=2192, 2200, &end
# Atom 1: H GLY 88, Atom 2: H HID 144
 &rst iat=1337, 2204, r3=6.000000, r4=6.500000, &end
# Atom 1: H MET 89, Atom 2: HB2 MET 89
 &rst iat=1344, 1348, r3=4.000000, r4=4.500000, &end
# Atom 1: H MET 89, Atom 2: HB3 MET 89
 &rst iat=1344, 1349, r3=4.000000, r4=4.500000, &end
# Atom 1: H MET 89, Atom 2: QE MET 89
 &rst iat=1344, -1, r3=5.300000, r4=5.800000, igr2=1357, 1358, 1359, &end
# Atom 1: H MET 89, Atom 2: H THR 90
 &rst iat=1344, 1363, r3=6.000000, r4=6.500000, &end
# Atom 1: H MET 89, Atom 2: QB CYS 94
 &rst iat=1344, -1, r3=6.880000, r4=7.380000, igr2=1415, 1416, &end
# Atom 1: H MET 89, Atom 2: QD ILE 98
 &rst iat=1344, -1, r3=7.000000, r4=7.500000, igr2=1484, 1485, 1486, &end
# Atom 1: H MET 89, Atom 2: QD PHE 143
 &rst iat=1344, -1, r3=8.000000, r4=8.500000, igr2=2192, 2200, &end
# Atom 1: H MET 89, Atom 2: QE PHE 143
 &rst iat=1344, -1, r3=8.000000, r4=8.500000, igr2=2194, 2198, &end
# Atom 1: QE MET 89, Atom 2: H VAL 95
 &rst iat=-1, 1424, r3=7.000000, r4=7.500000, igr1=1357, 1358, 1359, &end
# Atom 1: QE MET 89, Atom 2: H SER 118
 &rst iat=-1, 1774, r3=6.600000, r4=7.100000, igr1=1357, 1358, 1359, &end
# Atom 1: QE MET 89, Atom 2: H LYS 119
 &rst iat=-1, 1785, r3=7.000000, r4=7.500000, igr1=1357, 1358, 1359, &end
# Atom 1: H THR 90, Atom 2: H CYS 91
 &rst iat=1363, 1377, r3=6.000000, r4=6.500000, &end
# Atom 1: HB THR 90, Atom 2: H CYS 91
 &rst iat=1367, 1377, r3=5.400000, r4=5.900000, &end
# Atom 1: QG THR 90, Atom 2: H CYS 91
 &rst iat=1373, 1377, r3=7.000000, r4=7.500000, &end
# Atom 1: H CYS 91, Atom 2: QB ALA 92
 &rst iat=1377, -1, r3=7.000000, r4=7.500000, igr2=1394, 1395, 1396, &end
# Atom 1: H CYS 91, Atom 2: H CYS 94
 &rst iat=1377, 1411, r3=6.000000, r4=6.500000, &end
# Atom 1: H CYS 91, Atom 2: HB2 CYS 94
 &rst iat=1377, 1415, r3=6.000000, r4=6.500000, &end
# Atom 1: H CYS 91, Atom 2: HB3 CYS 94
 &rst iat=1377, 1416, r3=6.000000, r4=6.500000, &end
# Atom 1: H CYS 91, Atom 2: QB CYS 94
 &rst iat=1377, -1, r3=5.590000, r4=6.090000, igr2=1415, 1416, &end
# Atom 1: H CYS 91, Atom 2: H VAL 95
 &rst iat=1377, 1424, r3=6.000000, r4=6.500000, &end
# Atom 1: H CYS 91, Atom 2: QD1 LEU 115
 &rst iat=1377, -1, r3=7.000000, r4=7.500000, igr2=1740, 1741, 1742, &end
# Atom 1: H CYS 91, Atom 2: QD2 LEU 115
 &rst iat=1377, -1, r3=7.000000, r4=7.500000, igr2=1744, 1745, 1746, &end
# Atom 1: HA CYS 91, Atom 2: H CYS 94
 &rst iat=1379, 1411, r3=6.000000, r4=6.500000, &end
# Atom 1: QB CYS 91, Atom 2: H CYS 94
 &rst iat=-1, 1411, r3=5.680000, r4=6.180000, igr1=1381, 1382, &end
# Atom 1: QB ALA 92, Atom 2: H CYS 94
 &rst iat=-1, 1411, r3=7.000000, r4=7.500000, igr1=1394, 1395, 1396, &end
# Atom 1: QB ALA 92, Atom 2: H VAL 95
 &rst iat=-1, 1424, r3=6.100000, r4=6.600000, igr1=1394, 1395, 1396, &end
# Atom 1: QB ALA 92, Atom 2: H HID 96
 &rst iat=-1, 1440, r3=6.900000, r4=7.400000, igr1=1394, 1395, 1396, &end
# Atom 1: H SER 93, Atom 2: H CYS 94
 &rst iat=1400, 1411, r3=3.800000, r4=4.300000, &end
# Atom 1: H SER 93, Atom 2: H VAL 95
 &rst iat=1400, 1424, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 SER 93, Atom 2: H CYS 94
 &rst iat=1404, 1411, r3=4.700000, r4=5.200000, &end
# Atom 1: HB3 SER 93, Atom 2: H CYS 94
 &rst iat=1405, 1411, r3=4.700000, r4=5.200000, &end
# Atom 1: QB SER 93, Atom 2: H CYS 94
 &rst iat=-1, 1411, r3=4.180000, r4=4.680000, igr1=1404, 1405, &end
# Atom 1: H CYS 94, Atom 2: H VAL 95
 &rst iat=1411, 1424, r3=3.900000, r4=4.400000, &end
# Atom 1: H CYS 94, Atom 2: HB VAL 95
 &rst iat=1411, 1428, r3=5.000000, r4=5.500000, &end
# Atom 1: H CYS 94, Atom 2: QQG VAL 95
 &rst iat=1411, -1, r3=8.560000, r4=9.060000, igr2=1430, 1431, 1432, 1434, 1435, 1436, &end
# Atom 1: H CYS 94, Atom 2: QD ILE 98
 &rst iat=1411, -1, r3=7.000000, r4=7.500000, igr2=1484, 1485, 1486, &end
# Atom 1: H CYS 94, Atom 2: QQD LEU 115
 &rst iat=1411, -1, r3=8.570000, r4=9.070000, igr2=1740, 1741, 1742, 1744, 1745, 1746, &end
# Atom 1: H CYS 94, Atom 2: QE PHE 143
 &rst iat=1411, -1, r3=8.000000, r4=8.500000, igr2=2194, 2198, &end
# Atom 1: H CYS 94, Atom 2: HZ PHE 143
 &rst iat=1411, 2196, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 94, Atom 2: H HID 96
 &rst iat=1413, 1440, r3=5.200000, r4=5.700000, &end
# Atom 1: HA CYS 94, Atom 2: H ASN 97
 &rst iat=1413, 1457, r3=5.100000, r4=5.600000, &end
# Atom 1: HA CYS 94, Atom 2: QB ASN 97
 &rst iat=1413, -1, r3=6.880000, r4=7.380000, igr2=1461, 1462, &end
# Atom 1: HA CYS 94, Atom 2: HND1 ASN 97
 &rst iat=1413, 1466, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 94, Atom 2: HND2 ASN 97
 &rst iat=1413, 1467, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 94, Atom 2: H ILE 98
 &rst iat=1413, 1471, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 94, Atom 2: H VAL 95
 &rst iat=1415, 1424, r3=4.600000, r4=5.100000, &end
# Atom 1: HB3 CYS 94, Atom 2: H VAL 95
 &rst iat=1416, 1424, r3=4.600000, r4=5.100000, &end
# Atom 1: QB CYS 94, Atom 2: H VAL 95
 &rst iat=-1, 1424, r3=3.990000, r4=4.490000, igr1=1415, 1416, &end
# Atom 1: H VAL 95, Atom 2: HB VAL 95
 &rst iat=1424, 1428, r3=3.700000, r4=4.200000, &end
# Atom 1: H VAL 95, Atom 2: QG1 VAL 95
 &rst iat=1424, -1, r3=4.900000, r4=5.400000, igr2=1430, 1431, 1432, &end
# Atom 1: H VAL 95, Atom 2: QG2 VAL 95
 &rst iat=1424, -1, r3=4.900000, r4=5.400000, igr2=1434, 1435, 1436, &end
# Atom 1: H VAL 95, Atom 2: H HID 96
 &rst iat=1424, 1440, r3=4.100000, r4=4.600000, &end
# Atom 1: H VAL 95, Atom 2: HA HID 96
 &rst iat=1424, 1442, r3=5.700000, r4=6.200000, &end
# Atom 1: H VAL 95, Atom 2: H ASN 97
 &rst iat=1424, 1457, r3=6.000000, r4=6.500000, &end
# Atom 1: H VAL 95, Atom 2: QB ASN 97
 &rst iat=1424, -1, r3=6.880000, r4=7.380000, igr2=1461, 1462, &end
# Atom 1: H VAL 95, Atom 2: QD ILE 98
 &rst iat=1424, -1, r3=7.000000, r4=7.500000, igr2=1484, 1485, 1486, &end
# Atom 1: H VAL 95, Atom 2: H GLU 99
 &rst iat=1424, 1490, r3=6.000000, r4=6.500000, &end
# Atom 1: H VAL 95, Atom 2: QQG VAL 113
 &rst iat=1424, -1, r3=8.400000, r4=8.900000, igr2=1711, 1712, 1713, 1715, 1716, 1717, &end
# Atom 1: H VAL 95, Atom 2: HZ PHE 143
 &rst iat=1424, 2196, r3=6.000000, r4=6.500000, &end
# Atom 1: HA VAL 95, Atom 2: H ASN 97
 &rst iat=1426, 1457, r3=5.700000, r4=6.200000, &end
# Atom 1: HA VAL 95, Atom 2: H ILE 98
 &rst iat=1426, 1471, r3=4.600000, r4=5.100000, &end
# Atom 1: HA VAL 95, Atom 2: H GLU 99
 &rst iat=1426, 1490, r3=5.500000, r4=6.000000, &end
# Atom 1: HB VAL 95, Atom 2: H HID 96
 &rst iat=1428, 1440, r3=3.700000, r4=4.200000, &end
# Atom 1: HB VAL 95, Atom 2: H ASN 97
 &rst iat=1428, 1457, r3=5.400000, r4=5.900000, &end
# Atom 1: HB VAL 95, Atom 2: H ILE 98
 &rst iat=1428, 1471, r3=5.900000, r4=6.400000, &end
# Atom 1: HB VAL 95, Atom 2: H LEU 115
 &rst iat=1428, 1731, r3=6.000000, r4=6.500000, &end
# Atom 1: QG1 VAL 95, Atom 2: H HID 96
 &rst iat=-1, 1440, r3=6.500000, r4=7.000000, igr1=1430, 1431, 1432, &end
# Atom 1: QG1 VAL 95, Atom 2: H ASN 97
 &rst iat=-1, 1457, r3=7.000000, r4=7.500000, igr1=1430, 1431, 1432, &end
# Atom 1: QG2 VAL 95, Atom 2: H HID 96
 &rst iat=-1, 1440, r3=6.500000, r4=7.000000, igr1=1434, 1435, 1436, &end
# Atom 1: QG2 VAL 95, Atom 2: H ASN 97
 &rst iat=-1, 1457, r3=7.000000, r4=7.500000, igr1=1434, 1435, 1436, &end
# Atom 1: QQG VAL 95, Atom 2: H HID 96
 &rst iat=-1, 1440, r3=6.060000, r4=6.560000, igr1=1430, 1431, 1432, 1434, 1435, 1436, &end
# Atom 1: QQG VAL 95, Atom 2: H ILE 98
 &rst iat=-1, 1471, r3=8.260000, r4=8.760000, igr1=1430, 1431, 1432, 1434, 1435, 1436, &end
# Atom 1: QQG VAL 95, Atom 2: H GLU 99
 &rst iat=-1, 1490, r3=6.960000, r4=7.460000, igr1=1430, 1431, 1432, 1434, 1435, 1436, &end
# Atom 1: QQG VAL 95, Atom 2: H SER 100
 &rst iat=-1, 1505, r3=8.560000, r4=9.060000, igr1=1430, 1431, 1432, 1434, 1435, 1436, &end
# Atom 1: QQG VAL 95, Atom 2: H VAL 113
 &rst iat=-1, 1705, r3=8.160000, r4=8.660000, igr1=1430, 1431, 1432, 1434, 1435, 1436, &end
# Atom 1: QQG VAL 95, Atom 2: H LEU 115
 &rst iat=-1, 1731, r3=7.960000, r4=8.460000, igr1=1430, 1431, 1432, 1434, 1435, 1436, &end
# Atom 1: QQG VAL 95, Atom 2: H ALA 116
 &rst iat=-1, 1750, r3=8.560000, r4=9.060000, igr1=1430, 1431, 1432, 1434, 1435, 1436, &end
# Atom 1: H HID 96, Atom 2: HD HID 96
 &rst iat=1440, 1453, r3=5.800000, r4=6.300000, &end
# Atom 1: H HID 96, Atom 2: H ASN 97
 &rst iat=1440, 1457, r3=3.400000, r4=3.900000, &end
# Atom 1: H HID 96, Atom 2: QB ASN 97
 &rst iat=1440, -1, r3=6.380000, r4=6.880000, igr2=1461, 1462, &end
# Atom 1: H HID 96, Atom 2: QND ASN 97
 &rst iat=1440, -1, r3=6.870000, r4=7.370000, igr2=1466, 1467, &end
# Atom 1: H HID 96, Atom 2: H GLU 99
 &rst iat=1440, 1490, r3=6.000000, r4=6.500000, &end
# Atom 1: H HID 96, Atom 2: QB GLU 99
 &rst iat=1440, -1, r3=6.480000, r4=6.980000, igr2=1494, 1495, &end
# Atom 1: H HID 96, Atom 2: QQG VAL 113
 &rst iat=1440, -1, r3=8.400000, r4=8.900000, igr2=1711, 1712, 1713, 1715, 1716, 1717, &end
# Atom 1: HA HID 96, Atom 2: H ASN 97
 &rst iat=1442, 1457, r3=3.600000, r4=4.100000, &end
# Atom 1: HA HID 96, Atom 2: H GLU 99
 &rst iat=1442, 1490, r3=4.700000, r4=5.200000, &end
# Atom 1: QB HID 96, Atom 2: H ASN 97
 &rst iat=-1, 1457, r3=4.900000, r4=5.400000, igr1=1444, 1445, &end
# Atom 1: QB HID 96, Atom 2: H GLU 99
 &rst iat=-1, 1490, r3=6.300000, r4=6.800000, igr1=1444, 1445, &end
# Atom 1: QB HID 96, Atom 2: H SER 100
 &rst iat=-1, 1505, r3=7.000000, r4=7.500000, igr1=1444, 1445, &end
# Atom 1: HD HID 96, Atom 2: H ASN 97
 &rst iat=1453, 1457, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASN 97, Atom 2: HB2 ASN 97
 &rst iat=1457, 1461, r3=3.700000, r4=4.200000, &end
# Atom 1: H ASN 97, Atom 2: HB3 ASN 97
 &rst iat=1457, 1462, r3=3.700000, r4=4.200000, &end
# Atom 1: H ASN 97, Atom 2: QB ASN 97
 &rst iat=1457, -1, r3=3.390000, r4=3.890000, igr2=1461, 1462, &end
# Atom 1: H ASN 97, Atom 2: HND1 ASN 97
 &rst iat=1457, 1466, r3=5.700000, r4=6.200000, &end
# Atom 1: H ASN 97, Atom 2: HND2 ASN 97
 &rst iat=1457, 1467, r3=5.700000, r4=6.200000, &end
# Atom 1: H ASN 97, Atom 2: QND ASN 97
 &rst iat=1457, -1, r3=5.200000, r4=5.700000, igr2=1466, 1467, &end
# Atom 1: H ASN 97, Atom 2: H ILE 98
 &rst iat=1457, 1471, r3=3.800000, r4=4.300000, &end
# Atom 1: H ASN 97, Atom 2: HA ILE 98
 &rst iat=1457, 1473, r3=5.500000, r4=6.000000, &end
# Atom 1: H ASN 97, Atom 2: HB ILE 98
 &rst iat=1457, 1475, r3=4.900000, r4=5.400000, &end
# Atom 1: H ASN 97, Atom 2: QG2 ILE 98
 &rst iat=1457, -1, r3=7.000000, r4=7.500000, igr2=1477, 1478, 1479, &end
# Atom 1: H ASN 97, Atom 2: QG1 ILE 98
 &rst iat=1457, -1, r3=6.880000, r4=7.380000, igr2=1481, 1482, &end
# Atom 1: H ASN 97, Atom 2: QD ILE 98
 &rst iat=1457, -1, r3=7.000000, r4=7.500000, igr2=1484, 1485, 1486, &end
# Atom 1: H ASN 97, Atom 2: H GLU 99
 &rst iat=1457, 1490, r3=5.600000, r4=6.100000, &end
# Atom 1: H ASN 97, Atom 2: HB2 GLU 99
 &rst iat=1457, 1494, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASN 97, Atom 2: HB3 GLU 99
 &rst iat=1457, 1495, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASN 97, Atom 2: QB GLU 99
 &rst iat=1457, -1, r3=5.690000, r4=6.190000, igr2=1494, 1495, &end
# Atom 1: HA ASN 97, Atom 2: HND1 ASN 97
 &rst iat=1459, 1466, r3=5.400000, r4=5.900000, &end
# Atom 1: HA ASN 97, Atom 2: HND2 ASN 97
 &rst iat=1459, 1467, r3=5.400000, r4=5.900000, &end
# Atom 1: HA ASN 97, Atom 2: H GLU 99
 &rst iat=1459, 1490, r3=5.200000, r4=5.700000, &end
# Atom 1: HA ASN 97, Atom 2: H SER 100
 &rst iat=1459, 1505, r3=4.600000, r4=5.100000, &end
# Atom 1: HA ASN 97, Atom 2: H LYS 101
 &rst iat=1459, 1516, r3=5.200000, r4=5.700000, &end
# Atom 1: HB2 ASN 97, Atom 2: H ILE 98
 &rst iat=1461, 1471, r3=4.600000, r4=5.100000, &end
# Atom 1: HB2 ASN 97, Atom 2: H SER 100
 &rst iat=1461, 1505, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 ASN 97, Atom 2: H ILE 98
 &rst iat=1462, 1471, r3=4.600000, r4=5.100000, &end
# Atom 1: HB3 ASN 97, Atom 2: H SER 100
 &rst iat=1462, 1505, r3=6.000000, r4=6.500000, &end
# Atom 1: QB ASN 97, Atom 2: H ILE 98
 &rst iat=-1, 1471, r3=4.320000, r4=4.820000, igr1=1461, 1462, &end
# Atom 1: QB ASN 97, Atom 2: H GLU 99
 &rst iat=-1, 1490, r3=6.880000, r4=7.380000, igr1=1461, 1462, &end
# Atom 1: QB ASN 97, Atom 2: H SER 100
 &rst iat=-1, 1505, r3=5.550000, r4=6.050000, igr1=1461, 1462, &end
# Atom 1: QB ASN 97, Atom 2: H LYS 101
 &rst iat=-1, 1516, r3=6.880000, r4=7.380000, igr1=1461, 1462, &end
# Atom 1: HND1 ASN 97, Atom 2: HB ILE 141
 &rst iat=1466, 2162, r3=6.000000, r4=6.500000, &end
# Atom 1: HND1 ASN 97, Atom 2: QG2 ILE 141
 &rst iat=1466, -1, r3=6.300000, r4=6.800000, igr2=2164, 2165, 2166, &end
# Atom 1: HND1 ASN 97, Atom 2: QD ILE 141
 &rst iat=1466, -1, r3=5.800000, r4=6.300000, igr2=2171, 2172, 2173, &end
# Atom 1: HND1 ASN 97, Atom 2: QE PHE 143
 &rst iat=1466, -1, r3=8.000000, r4=8.500000, igr2=2194, 2198, &end
# Atom 1: HND2 ASN 97, Atom 2: HB ILE 141
 &rst iat=1467, 2162, r3=6.000000, r4=6.500000, &end
# Atom 1: HND2 ASN 97, Atom 2: QG2 ILE 141
 &rst iat=1467, -1, r3=6.300000, r4=6.800000, igr2=2164, 2165, 2166, &end
# Atom 1: HND2 ASN 97, Atom 2: QD ILE 141
 &rst iat=1467, -1, r3=5.800000, r4=6.300000, igr2=2171, 2172, 2173, &end
# Atom 1: HND2 ASN 97, Atom 2: QE PHE 143
 &rst iat=1467, -1, r3=8.000000, r4=8.500000, igr2=2194, 2198, &end
# Atom 1: QND ASN 97, Atom 2: QG2 ILE 141
 &rst iat=-1, -1, r3=5.900000, r4=6.400000, 
 igr1=1466, 1467, igr2=2164, 2165, 2166, &end
# Atom 1: QND ASN 97, Atom 2: QD ILE 141
 &rst iat=-1, -1, r3=5.590000, r4=6.090000, 
 igr1=1466, 1467, igr2=2171, 2172, 2173, &end
# Atom 1: H ILE 98, Atom 2: HB ILE 98
 &rst iat=1471, 1475, r3=3.300000, r4=3.800000, &end
# Atom 1: H ILE 98, Atom 2: QG2 ILE 98
 &rst iat=1471, -1, r3=4.500000, r4=5.000000, igr2=1477, 1478, 1479, &end
# Atom 1: H ILE 98, Atom 2: HG12 ILE 98
 &rst iat=1471, 1481, r3=3.900000, r4=4.400000, &end
# Atom 1: H ILE 98, Atom 2: HG13 ILE 98
 &rst iat=1471, 1482, r3=3.900000, r4=4.400000, &end
# Atom 1: H ILE 98, Atom 2: QG1 ILE 98
 &rst iat=1471, -1, r3=3.550000, r4=4.050000, igr2=1481, 1482, &end
# Atom 1: H ILE 98, Atom 2: QD ILE 98
 &rst iat=1471, -1, r3=5.200000, r4=5.700000, igr2=1484, 1485, 1486, &end
# Atom 1: H ILE 98, Atom 2: H GLU 99
 &rst iat=1471, 1490, r3=3.900000, r4=4.400000, &end
# Atom 1: H ILE 98, Atom 2: QB GLU 99
 &rst iat=1471, -1, r3=5.780000, r4=6.280000, igr2=1494, 1495, &end
# Atom 1: H ILE 98, Atom 2: QG GLU 99
 &rst iat=1471, -1, r3=6.880000, r4=7.380000, igr2=1497, 1498, &end
# Atom 1: H ILE 98, Atom 2: H SER 100
 &rst iat=1471, 1505, r3=5.600000, r4=6.100000, &end
# Atom 1: H ILE 98, Atom 2: H LYS 101
 &rst iat=1471, 1516, r3=5.500000, r4=6.000000, &end
# Atom 1: H ILE 98, Atom 2: QB LYS 101
 &rst iat=1471, -1, r3=5.980000, r4=6.480000, igr2=1520, 1521, &end
# Atom 1: H ILE 98, Atom 2: QE PHE 143
 &rst iat=1471, -1, r3=8.000000, r4=8.500000, igr2=2194, 2198, &end
# Atom 1: HA ILE 98, Atom 2: H SER 100
 &rst iat=1473, 1505, r3=4.600000, r4=5.100000, &end
# Atom 1: HA ILE 98, Atom 2: H LYS 101
 &rst iat=1473, 1516, r3=4.900000, r4=5.400000, &end
# Atom 1: HB ILE 98, Atom 2: H GLU 99
 &rst iat=1475, 1490, r3=3.800000, r4=4.300000, &end
# Atom 1: HB ILE 98, Atom 2: H SER 100
 &rst iat=1475, 1505, r3=6.000000, r4=6.500000, &end
# Atom 1: QG2 ILE 98, Atom 2: H GLU 99
 &rst iat=-1, 1490, r3=6.100000, r4=6.600000, igr1=1477, 1478, 1479, &end
# Atom 1: QG2 ILE 98, Atom 2: H LYS 101
 &rst iat=-1, 1516, r3=7.000000, r4=7.500000, igr1=1477, 1478, 1479, &end
# Atom 1: QG1 ILE 98, Atom 2: H GLU 99
 &rst iat=-1, 1490, r3=6.880000, r4=7.380000, igr1=1481, 1482, &end
# Atom 1: QD ILE 98, Atom 2: H GLU 99
 &rst iat=-1, 1490, r3=7.000000, r4=7.500000, igr1=1484, 1485, 1486, &end
# Atom 1: QD ILE 98, Atom 2: H PHE 143
 &rst iat=-1, 2184, r3=7.000000, r4=7.500000, igr1=1484, 1485, 1486, &end
# Atom 1: QD ILE 98, Atom 2: H HID 144
 &rst iat=-1, 2204, r3=7.000000, r4=7.500000, igr1=1484, 1485, 1486, &end
# Atom 1: H GLU 99, Atom 2: HB2 GLU 99
 &rst iat=1490, 1494, r3=4.000000, r4=4.500000, &end
# Atom 1: H GLU 99, Atom 2: HB3 GLU 99
 &rst iat=1490, 1495, r3=4.000000, r4=4.500000, &end
# Atom 1: H GLU 99, Atom 2: QB GLU 99
 &rst iat=1490, -1, r3=3.650000, r4=4.150000, igr2=1494, 1495, &end
# Atom 1: H GLU 99, Atom 2: HG2 GLU 99
 &rst iat=1490, 1497, r3=4.400000, r4=4.900000, &end
# Atom 1: H GLU 99, Atom 2: HG3 GLU 99
 &rst iat=1490, 1498, r3=4.400000, r4=4.900000, &end
# Atom 1: H GLU 99, Atom 2: QG GLU 99
 &rst iat=1490, -1, r3=4.110000, r4=4.610000, igr2=1497, 1498, &end
# Atom 1: H GLU 99, Atom 2: H SER 100
 &rst iat=1490, 1505, r3=3.700000, r4=4.200000, &end
# Atom 1: H GLU 99, Atom 2: HA SER 100
 &rst iat=1490, 1507, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLU 99, Atom 2: QB SER 100
 &rst iat=1490, -1, r3=6.880000, r4=7.380000, igr2=1509, 1510, &end
# Atom 1: H GLU 99, Atom 2: H LYS 101
 &rst iat=1490, 1516, r3=5.900000, r4=6.400000, &end
# Atom 1: H GLU 99, Atom 2: QD LYS 101
 &rst iat=1490, -1, r3=5.980000, r4=6.480000, igr2=1526, 1527, &end
# Atom 1: H GLU 99, Atom 2: H LEU 102
 &rst iat=1490, 1538, r3=5.000000, r4=5.500000, &end
# Atom 1: H GLU 99, Atom 2: QB LEU 102
 &rst iat=1490, -1, r3=6.380000, r4=6.880000, igr2=1542, 1543, &end
# Atom 1: H GLU 99, Atom 2: H THR 103
 &rst iat=1490, 1557, r3=5.800000, r4=6.300000, &end
# Atom 1: H GLU 99, Atom 2: QQG VAL 113
 &rst iat=1490, -1, r3=8.400000, r4=8.900000, igr2=1711, 1712, 1713, 1715, 1716, 1717, &end
# Atom 1: HA GLU 99, Atom 2: H LEU 102
 &rst iat=1492, 1538, r3=5.100000, r4=5.600000, &end
# Atom 1: HA GLU 99, Atom 2: H THR 103
 &rst iat=1492, 1557, r3=5.600000, r4=6.100000, &end
# Atom 1: HA GLU 99, Atom 2: H VAL 113
 &rst iat=1492, 1705, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 GLU 99, Atom 2: H SER 100
 &rst iat=1494, 1505, r3=3.800000, r4=4.300000, &end
# Atom 1: HB3 GLU 99, Atom 2: H SER 100
 &rst iat=1495, 1505, r3=3.800000, r4=4.300000, &end
# Atom 1: QB GLU 99, Atom 2: H ALA 111
 &rst iat=-1, 1684, r3=6.880000, r4=7.380000, igr1=1494, 1495, &end
# Atom 1: HG2 GLU 99, Atom 2: H SER 100
 &rst iat=1497, 1505, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 GLU 99, Atom 2: H VAL 113
 &rst iat=1497, 1705, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLU 99, Atom 2: H SER 100
 &rst iat=1498, 1505, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLU 99, Atom 2: H VAL 113
 &rst iat=1498, 1705, r3=6.000000, r4=6.500000, &end
# Atom 1: QG GLU 99, Atom 2: H SER 100
 &rst iat=-1, 1505, r3=5.790000, r4=6.290000, igr1=1497, 1498, &end
# Atom 1: QG GLU 99, Atom 2: H THR 103
 &rst iat=-1, 1557, r3=6.880000, r4=7.380000, igr1=1497, 1498, &end
# Atom 1: QG GLU 99, Atom 2: H ALA 111
 &rst iat=-1, 1684, r3=6.880000, r4=7.380000, igr1=1497, 1498, &end
# Atom 1: QG GLU 99, Atom 2: H VAL 113
 &rst iat=-1, 1705, r3=5.840000, r4=6.340000, igr1=1497, 1498, &end
# Atom 1: H SER 100, Atom 2: HB2 SER 100
 &rst iat=1505, 1509, r3=3.600000, r4=4.100000, &end
# Atom 1: H SER 100, Atom 2: HB3 SER 100
 &rst iat=1505, 1510, r3=3.600000, r4=4.100000, &end
# Atom 1: H SER 100, Atom 2: H LYS 101
 &rst iat=1505, 1516, r3=3.700000, r4=4.200000, &end
# Atom 1: H SER 100, Atom 2: QB LYS 101
 &rst iat=1505, -1, r3=5.880000, r4=6.380000, igr2=1520, 1521, &end
# Atom 1: H SER 100, Atom 2: H LEU 102
 &rst iat=1505, 1538, r3=5.300000, r4=5.800000, &end
# Atom 1: H SER 100, Atom 2: QQD LEU 102
 &rst iat=1505, -1, r3=8.570000, r4=9.070000, igr2=1547, 1548, 1549, 1551, 1552, 1553, &end
# Atom 1: H SER 100, Atom 2: H THR 103
 &rst iat=1505, 1557, r3=5.500000, r4=6.000000, &end
# Atom 1: HA SER 100, Atom 2: H THR 103
 &rst iat=1507, 1557, r3=4.700000, r4=5.200000, &end
# Atom 1: QB SER 100, Atom 2: H LYS 101
 &rst iat=-1, 1516, r3=4.480000, r4=4.980000, igr1=1509, 1510, &end
# Atom 1: QB SER 100, Atom 2: H LEU 102
 &rst iat=-1, 1538, r3=6.780000, r4=7.280000, igr1=1509, 1510, &end
# Atom 1: H LYS 101, Atom 2: HB2 LYS 101
 &rst iat=1516, 1520, r3=3.400000, r4=3.900000, &end
# Atom 1: H LYS 101, Atom 2: HB3 LYS 101
 &rst iat=1516, 1521, r3=3.400000, r4=3.900000, &end
# Atom 1: H LYS 101, Atom 2: HG2 LYS 101
 &rst iat=1516, 1523, r3=4.300000, r4=4.800000, &end
# Atom 1: H LYS 101, Atom 2: HG3 LYS 101
 &rst iat=1516, 1524, r3=4.300000, r4=4.800000, &end
# Atom 1: H LYS 101, Atom 2: HD2 LYS 101
 &rst iat=1516, 1526, r3=4.300000, r4=4.800000, &end
# Atom 1: H LYS 101, Atom 2: HD3 LYS 101
 &rst iat=1516, 1527, r3=4.300000, r4=4.800000, &end
# Atom 1: H LYS 101, Atom 2: QD LYS 101
 &rst iat=1516, -1, r3=3.960000, r4=4.460000, igr2=1526, 1527, &end
# Atom 1: H LYS 101, Atom 2: HE2 LYS 101
 &rst iat=1516, 1529, r3=6.000000, r4=6.500000, &end
# Atom 1: H LYS 101, Atom 2: HE3 LYS 101
 &rst iat=1516, 1530, r3=6.000000, r4=6.500000, &end
# Atom 1: H LYS 101, Atom 2: QE LYS 101
 &rst iat=1516, -1, r3=5.500000, r4=6.000000, igr2=1529, 1530, &end
# Atom 1: H LYS 101, Atom 2: H LEU 102
 &rst iat=1516, 1538, r3=3.500000, r4=4.000000, &end
# Atom 1: H LYS 101, Atom 2: QQD LEU 102
 &rst iat=1516, -1, r3=8.170000, r4=8.670000, igr2=1547, 1548, 1549, 1551, 1552, 1553, &end
# Atom 1: H LYS 101, Atom 2: H THR 103
 &rst iat=1516, 1557, r3=5.800000, r4=6.300000, &end
# Atom 1: H LYS 101, Atom 2: H ARG 104
 &rst iat=1516, 1571, r3=5.800000, r4=6.300000, &end
# Atom 1: H LYS 101, Atom 2: QD ILE 141
 &rst iat=1516, -1, r3=6.500000, r4=7.000000, igr2=2171, 2172, 2173, &end
# Atom 1: HA LYS 101, Atom 2: H ARG 104
 &rst iat=1518, 1571, r3=4.300000, r4=4.800000, &end
# Atom 1: QB LYS 101, Atom 2: H LEU 102
 &rst iat=-1, 1538, r3=4.780000, r4=5.280000, igr1=1520, 1521, &end
# Atom 1: QB LYS 101, Atom 2: H THR 103
 &rst iat=-1, 1557, r3=6.380000, r4=6.880000, igr1=1520, 1521, &end
# Atom 1: QG LYS 101, Atom 2: H LEU 102
 &rst iat=-1, 1538, r3=6.880000, r4=7.380000, igr1=1523, 1524, &end
# Atom 1: QD LYS 101, Atom 2: H LEU 102
 &rst iat=-1, 1538, r3=6.880000, r4=7.380000, igr1=1526, 1527, &end
# Atom 1: QE LYS 101, Atom 2: H ILE 141
 &rst iat=-1, 2158, r3=6.880000, r4=7.380000, igr1=1529, 1530, &end
# Atom 1: H LEU 102, Atom 2: HB2 LEU 102
 &rst iat=1538, 1542, r3=3.700000, r4=4.200000, &end
# Atom 1: H LEU 102, Atom 2: HB3 LEU 102
 &rst iat=1538, 1543, r3=3.700000, r4=4.200000, &end
# Atom 1: H LEU 102, Atom 2: QB LEU 102
 &rst iat=1538, -1, r3=3.440000, r4=3.940000, igr2=1542, 1543, &end
# Atom 1: H LEU 102, Atom 2: HG LEU 102
 &rst iat=1538, 1545, r3=3.600000, r4=4.100000, &end
# Atom 1: H LEU 102, Atom 2: QD1 LEU 102
 &rst iat=1538, -1, r3=4.800000, r4=5.300000, igr2=1547, 1548, 1549, &end
# Atom 1: H LEU 102, Atom 2: QD2 LEU 102
 &rst iat=1538, -1, r3=4.800000, r4=5.300000, igr2=1551, 1552, 1553, &end
# Atom 1: H LEU 102, Atom 2: HB THR 103
 &rst iat=1538, 1561, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 102, Atom 2: H ARG 104
 &rst iat=1538, 1571, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 102, Atom 2: QG2 ILE 108
 &rst iat=1538, -1, r3=6.300000, r4=6.800000, igr2=1636, 1637, 1638, &end
# Atom 1: H LEU 102, Atom 2: QG2 ILE 138
 &rst iat=1538, -1, r3=6.800000, r4=7.300000, igr2=2115, 2116, 2117, &end
# Atom 1: HA LEU 102, Atom 2: H ARG 104
 &rst iat=1540, 1571, r3=4.600000, r4=5.100000, &end
# Atom 1: HA LEU 102, Atom 2: H THR 105
 &rst iat=1540, 1595, r3=5.000000, r4=5.500000, &end
# Atom 1: HB2 LEU 102, Atom 2: H THR 103
 &rst iat=1542, 1557, r3=4.000000, r4=4.500000, &end
# Atom 1: HB3 LEU 102, Atom 2: H THR 103
 &rst iat=1543, 1557, r3=4.000000, r4=4.500000, &end
# Atom 1: QB LEU 102, Atom 2: H ARG 104
 &rst iat=-1, 1571, r3=6.280000, r4=6.780000, igr1=1542, 1543, &end
# Atom 1: QD1 LEU 102, Atom 2: H THR 103
 &rst iat=-1, 1557, r3=7.000000, r4=7.500000, igr1=1547, 1548, 1549, &end
# Atom 1: QD1 LEU 102, Atom 2: H ARG 104
 &rst iat=-1, 1571, r3=7.000000, r4=7.500000, igr1=1547, 1548, 1549, &end
# Atom 1: QD2 LEU 102, Atom 2: H THR 103
 &rst iat=-1, 1557, r3=7.000000, r4=7.500000, igr1=1551, 1552, 1553, &end
# Atom 1: QD2 LEU 102, Atom 2: H ARG 104
 &rst iat=-1, 1571, r3=7.000000, r4=7.500000, igr1=1551, 1552, 1553, &end
# Atom 1: QQD LEU 102, Atom 2: H THR 105
 &rst iat=-1, 1595, r3=8.570000, r4=9.070000, igr1=1547, 1548, 1549, 1551, 1552, 1553, &end
# Atom 1: QQD LEU 102, Atom 2: H ALA 111
 &rst iat=-1, 1684, r3=8.570000, r4=9.070000, igr1=1547, 1548, 1549, 1551, 1552, 1553, &end
# Atom 1: QQD LEU 102, Atom 2: H SER 112
 &rst iat=-1, 1694, r3=8.570000, r4=9.070000, igr1=1547, 1548, 1549, 1551, 1552, 1553, &end
# Atom 1: QQD LEU 102, Atom 2: H VAL 113
 &rst iat=-1, 1705, r3=8.570000, r4=9.070000, igr1=1547, 1548, 1549, 1551, 1552, 1553, &end
# Atom 1: H THR 103, Atom 2: HB THR 103
 &rst iat=1557, 1561, r3=3.900000, r4=4.400000, &end
# Atom 1: H THR 103, Atom 2: QG THR 103
 &rst iat=1557, 1567, r3=4.300000, r4=4.800000, &end
# Atom 1: H THR 103, Atom 2: H ARG 104
 &rst iat=1557, 1571, r3=3.700000, r4=4.200000, &end
# Atom 1: H THR 103, Atom 2: HA ARG 104
 &rst iat=1557, 1573, r3=6.000000, r4=6.500000, &end
# Atom 1: H THR 103, Atom 2: QB ARG 104
 &rst iat=1557, -1, r3=5.780000, r4=6.280000, igr2=1575, 1576, &end
# Atom 1: H THR 103, Atom 2: H THR 105
 &rst iat=1557, 1595, r3=6.000000, r4=6.500000, &end
# Atom 1: H THR 103, Atom 2: QG2 ILE 108
 &rst iat=1557, -1, r3=6.600000, r4=7.100000, igr2=1636, 1637, 1638, &end
# Atom 1: HA THR 103, Atom 2: H THR 105
 &rst iat=1559, 1595, r3=4.900000, r4=5.400000, &end
# Atom 1: HB THR 103, Atom 2: H ARG 104
 &rst iat=1561, 1571, r3=4.100000, r4=4.600000, &end
# Atom 1: QG THR 103, Atom 2: H ARG 104
 &rst iat=1567, 1571, r3=6.600000, r4=7.100000, &end
# Atom 1: QG THR 103, Atom 2: H ALA 111
 &rst iat=1567, 1684, r3=6.200000, r4=6.700000, &end
# Atom 1: H ARG 104, Atom 2: HB2 ARG 104
 &rst iat=1571, 1575, r3=3.700000, r4=4.200000, &end
# Atom 1: H ARG 104, Atom 2: HB3 ARG 104
 &rst iat=1571, 1576, r3=3.700000, r4=4.200000, &end
# Atom 1: H ARG 104, Atom 2: QB ARG 104
 &rst iat=1571, -1, r3=3.440000, r4=3.940000, igr2=1575, 1576, &end
# Atom 1: H ARG 104, Atom 2: QG ARG 104
 &rst iat=1571, -1, r3=4.900000, r4=5.400000, igr2=1578, 1579, &end
# Atom 1: H ARG 104, Atom 2: QD ARG 104
 &rst iat=1571, -1, r3=6.100000, r4=6.600000, igr2=1581, 1582, &end
# Atom 1: H ARG 104, Atom 2: H THR 105
 &rst iat=1571, 1595, r3=4.000000, r4=4.500000, &end
# Atom 1: H ARG 104, Atom 2: QG2 ILE 108
 &rst iat=1571, -1, r3=7.000000, r4=7.500000, igr2=1636, 1637, 1638, &end
# Atom 1: QG ARG 104, Atom 2: H THR 105
 &rst iat=-1, 1595, r3=6.800000, r4=7.300000, igr1=1578, 1579, &end
# Atom 1: QD ARG 104, Atom 2: H THR 105
 &rst iat=-1, 1595, r3=7.000000, r4=7.500000, igr1=1581, 1582, &end
# Atom 1: H THR 105, Atom 2: HB THR 105
 &rst iat=1595, 1599, r3=3.200000, r4=3.700000, &end
# Atom 1: H THR 105, Atom 2: QG THR 105
 &rst iat=1595, 1605, r3=4.600000, r4=5.100000, &end
# Atom 1: H THR 105, Atom 2: H ASN 106
 &rst iat=1595, 1609, r3=5.200000, r4=5.700000, &end
# Atom 1: H THR 105, Atom 2: HB ILE 108
 &rst iat=1595, 1634, r3=5.300000, r4=5.800000, &end
# Atom 1: H THR 105, Atom 2: QG2 ILE 108
 &rst iat=1595, -1, r3=5.800000, r4=6.300000, igr2=1636, 1637, 1638, &end
# Atom 1: H THR 105, Atom 2: QG1 ILE 108
 &rst iat=1595, -1, r3=6.880000, r4=7.380000, igr2=1640, 1641, &end
# Atom 1: H THR 105, Atom 2: QD ILE 108
 &rst iat=1595, -1, r3=7.000000, r4=7.500000, igr2=1643, 1644, 1645, &end
# Atom 1: H THR 105, Atom 2: QG1 ILE 129
 &rst iat=1595, -1, r3=6.880000, r4=7.380000, igr2=1964, 1965, &end
# Atom 1: HA THR 105, Atom 2: H ASN 106
 &rst iat=1597, 1609, r3=3.600000, r4=4.100000, &end
# Atom 1: HA THR 105, Atom 2: QND ASN 106
 &rst iat=1597, -1, r3=6.870000, r4=7.370000, igr2=1618, 1619, &end
# Atom 1: HA THR 105, Atom 2: H ILE 108
 &rst iat=1597, 1630, r3=6.000000, r4=6.500000, &end
# Atom 1: QG THR 105, Atom 2: H ASN 106
 &rst iat=1605, 1609, r3=6.300000, r4=6.800000, &end
# Atom 1: QG THR 105, Atom 2: H ILE 108
 &rst iat=1605, 1630, r3=6.300000, r4=6.800000, &end
# Atom 1: H ASN 106, Atom 2: HB2 ASN 106
 &rst iat=1609, 1613, r3=4.200000, r4=4.700000, &end
# Atom 1: H ASN 106, Atom 2: HB3 ASN 106
 &rst iat=1609, 1614, r3=4.200000, r4=4.700000, &end
# Atom 1: H ASN 106, Atom 2: HND1 ASN 106
 &rst iat=1609, 1618, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASN 106, Atom 2: HND2 ASN 106
 &rst iat=1609, 1619, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASN 106, Atom 2: H GLY 107
 &rst iat=1609, 1623, r3=5.200000, r4=5.700000, &end
# Atom 1: H ASN 106, Atom 2: H ILE 108
 &rst iat=1609, 1630, r3=5.200000, r4=5.700000, &end
# Atom 1: HA ASN 106, Atom 2: HND1 ASN 106
 &rst iat=1611, 1618, r3=5.400000, r4=5.900000, &end
# Atom 1: HA ASN 106, Atom 2: HND2 ASN 106
 &rst iat=1611, 1619, r3=5.400000, r4=5.900000, &end
# Atom 1: HB2 ASN 106, Atom 2: H GLY 107
 &rst iat=1613, 1623, r3=4.500000, r4=5.000000, &end
# Atom 1: HB3 ASN 106, Atom 2: H GLY 107
 &rst iat=1614, 1623, r3=4.500000, r4=5.000000, &end
# Atom 1: QB ASN 106, Atom 2: H ILE 108
 &rst iat=-1, 1630, r3=6.880000, r4=7.380000, igr1=1613, 1614, &end
# Atom 1: HND1 ASN 106, Atom 2: HG12 ILE 128
 &rst iat=1618, 1945, r3=6.000000, r4=6.500000, &end
# Atom 1: HND1 ASN 106, Atom 2: HG13 ILE 128
 &rst iat=1618, 1946, r3=6.000000, r4=6.500000, &end
# Atom 1: HND1 ASN 106, Atom 2: QD ILE 128
 &rst iat=1618, -1, r3=5.900000, r4=6.400000, igr2=1948, 1949, 1950, &end
# Atom 1: HND2 ASN 106, Atom 2: HG12 ILE 128
 &rst iat=1619, 1945, r3=6.000000, r4=6.500000, &end
# Atom 1: HND2 ASN 106, Atom 2: HG13 ILE 128
 &rst iat=1619, 1946, r3=6.000000, r4=6.500000, &end
# Atom 1: HND2 ASN 106, Atom 2: QD ILE 128
 &rst iat=1619, -1, r3=5.900000, r4=6.400000, igr2=1948, 1949, 1950, &end
# Atom 1: QND ASN 106, Atom 2: HB ILE 128
 &rst iat=-1, 1939, r3=6.870000, r4=7.370000, igr1=1618, 1619, &end
# Atom 1: QND ASN 106, Atom 2: QG1 ILE 128
 &rst iat=-1, -1, r3=5.670000, r4=6.170000, 
 igr1=1618, 1619, igr2=1945, 1946, &end
# Atom 1: QND ASN 106, Atom 2: QD ILE 128
 &rst iat=-1, -1, r3=5.740000, r4=6.240000, 
 igr1=1618, 1619, igr2=1948, 1949, 1950, &end
# Atom 1: H GLY 107, Atom 2: H ILE 108
 &rst iat=1623, 1630, r3=3.600000, r4=4.100000, &end
# Atom 1: H GLY 107, Atom 2: HB ILE 108
 &rst iat=1623, 1634, r3=5.300000, r4=5.800000, &end
# Atom 1: H GLY 107, Atom 2: QG2 ILE 108
 &rst iat=1623, -1, r3=6.300000, r4=6.800000, igr2=1636, 1637, 1638, &end
# Atom 1: H GLY 107, Atom 2: QG1 ILE 108
 &rst iat=1623, -1, r3=6.880000, r4=7.380000, igr2=1640, 1641, &end
# Atom 1: H GLY 107, Atom 2: QB ASP 125
 &rst iat=1623, -1, r3=6.880000, r4=7.380000, igr2=1898, 1899, &end
# Atom 1: H GLY 107, Atom 2: HB ILE 128
 &rst iat=1623, 1939, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 107, Atom 2: QG1 ILE 128
 &rst iat=1623, -1, r3=6.880000, r4=7.380000, igr2=1945, 1946, &end
# Atom 1: H GLY 107, Atom 2: QD ILE 128
 &rst iat=1623, -1, r3=5.800000, r4=6.300000, igr2=1948, 1949, 1950, &end
# Atom 1: H GLY 107, Atom 2: HB ILE 129
 &rst iat=1623, 1958, r3=6.000000, r4=6.500000, &end
# Atom 1: QA GLY 107, Atom 2: H ASP 125
 &rst iat=-1, 1894, r3=6.880000, r4=7.380000, igr1=1625, 1626, &end
# Atom 1: H ILE 108, Atom 2: HB ILE 108
 &rst iat=1630, 1634, r3=3.200000, r4=3.700000, &end
# Atom 1: H ILE 108, Atom 2: QG2 ILE 108
 &rst iat=1630, -1, r3=4.200000, r4=4.700000, igr2=1636, 1637, 1638, &end
# Atom 1: H ILE 108, Atom 2: HG12 ILE 108
 &rst iat=1630, 1640, r3=4.800000, r4=5.300000, &end
# Atom 1: H ILE 108, Atom 2: HG13 ILE 108
 &rst iat=1630, 1641, r3=4.800000, r4=5.300000, &end
# Atom 1: H ILE 108, Atom 2: QG1 ILE 108
 &rst iat=1630, -1, r3=4.470000, r4=4.970000, igr2=1640, 1641, &end
# Atom 1: H ILE 108, Atom 2: QD ILE 108
 &rst iat=1630, -1, r3=5.900000, r4=6.400000, igr2=1643, 1644, 1645, &end
# Atom 1: H ILE 108, Atom 2: H THR 109
 &rst iat=1630, 1649, r3=4.600000, r4=5.100000, &end
# Atom 1: H ILE 108, Atom 2: HA PHE 124
 &rst iat=1630, 1876, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 108, Atom 2: QB PHE 124
 &rst iat=1630, -1, r3=7.000000, r4=7.500000, igr2=1878, 1879, &end
# Atom 1: H ILE 108, Atom 2: H ASP 125
 &rst iat=1630, 1894, r3=5.700000, r4=6.200000, &end
# Atom 1: H ILE 108, Atom 2: QG1 ILE 129
 &rst iat=1630, -1, r3=6.880000, r4=7.380000, igr2=1964, 1965, &end
# Atom 1: HA ILE 108, Atom 2: H PHE 124
 &rst iat=1632, 1874, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ILE 108, Atom 2: HA PHE 124
 &rst iat=1632, 1876, r3=4.300000, r4=4.800000, &end
# Atom 1: HA ILE 108, Atom 2: H ASP 125
 &rst iat=1632, 1894, r3=5.000000, r4=5.500000, &end
# Atom 1: HB ILE 108, Atom 2: H ASP 125
 &rst iat=1634, 1894, r3=6.000000, r4=6.500000, &end
# Atom 1: QG2 ILE 108, Atom 2: H THR 109
 &rst iat=-1, 1649, r3=5.400000, r4=5.900000, igr1=1636, 1637, 1638, &end
# Atom 1: QG2 ILE 108, Atom 2: H TYR 110
 &rst iat=-1, 1663, r3=7.000000, r4=7.500000, igr1=1636, 1637, 1638, &end
# Atom 1: QG1 ILE 108, Atom 2: H THR 109
 &rst iat=-1, 1649, r3=6.880000, r4=7.380000, igr1=1640, 1641, &end
# Atom 1: QG1 ILE 108, Atom 2: H TYR 110
 &rst iat=-1, 1663, r3=6.880000, r4=7.380000, igr1=1640, 1641, &end
# Atom 1: QG1 ILE 108, Atom 2: H LYS 123
 &rst iat=-1, 1852, r3=6.880000, r4=7.380000, igr1=1640, 1641, &end
# Atom 1: QG1 ILE 108, Atom 2: H PHE 124
 &rst iat=-1, 1874, r3=6.880000, r4=7.380000, igr1=1640, 1641, &end
# Atom 1: QG1 ILE 108, Atom 2: H ASP 125
 &rst iat=-1, 1894, r3=6.880000, r4=7.380000, igr1=1640, 1641, &end
# Atom 1: QD ILE 108, Atom 2: H TYR 110
 &rst iat=-1, 1663, r3=7.000000, r4=7.500000, igr1=1643, 1644, 1645, &end
# Atom 1: QD ILE 108, Atom 2: H LYS 123
 &rst iat=-1, 1852, r3=5.500000, r4=6.000000, igr1=1643, 1644, 1645, &end
# Atom 1: QD ILE 108, Atom 2: H PHE 124
 &rst iat=-1, 1874, r3=7.000000, r4=7.500000, igr1=1643, 1644, 1645, &end
# Atom 1: H THR 109, Atom 2: QG THR 109
 &rst iat=1649, 1659, r3=4.800000, r4=5.300000, &end
# Atom 1: H THR 109, Atom 2: H TYR 110
 &rst iat=1649, 1663, r3=3.800000, r4=4.300000, &end
# Atom 1: H THR 109, Atom 2: QD TYR 110
 &rst iat=1649, -1, r3=8.000000, r4=8.500000, igr2=1671, 1680, &end
# Atom 1: H THR 109, Atom 2: H ALA 111
 &rst iat=1649, 1684, r3=6.000000, r4=6.500000, &end
# Atom 1: H THR 109, Atom 2: HA PHE 124
 &rst iat=1649, 1876, r3=6.000000, r4=6.500000, &end
# Atom 1: H THR 109, Atom 2: QB PHE 124
 &rst iat=1649, -1, r3=7.000000, r4=7.500000, igr2=1878, 1879, &end
# Atom 1: HA THR 109, Atom 2: H ALA 111
 &rst iat=1651, 1684, r3=5.900000, r4=6.400000, &end
# Atom 1: HB THR 109, Atom 2: H TYR 110
 &rst iat=1653, 1663, r3=4.900000, r4=5.400000, &end
# Atom 1: QG THR 109, Atom 2: H TYR 110
 &rst iat=1659, 1663, r3=5.700000, r4=6.200000, &end
# Atom 1: H TYR 110, Atom 2: QE TYR 110
 &rst iat=1663, -1, r3=7.000000, r4=7.500000, igr2=1673, 1678, &end
# Atom 1: H TYR 110, Atom 2: HA VAL 122
 &rst iat=1663, 1838, r3=5.300000, r4=5.800000, &end
# Atom 1: H TYR 110, Atom 2: H LYS 123
 &rst iat=1663, 1852, r3=4.800000, r4=5.300000, &end
# Atom 1: H TYR 110, Atom 2: QB LYS 123
 &rst iat=1663, -1, r3=7.000000, r4=7.500000, igr2=1856, 1857, &end
# Atom 1: H TYR 110, Atom 2: QG LYS 123
 &rst iat=1663, -1, r3=6.880000, r4=7.380000, igr2=1859, 1860, &end
# Atom 1: H TYR 110, Atom 2: HA PHE 124
 &rst iat=1663, 1876, r3=5.400000, r4=5.900000, &end
# Atom 1: H TYR 110, Atom 2: QB PHE 124
 &rst iat=1663, -1, r3=7.000000, r4=7.500000, igr2=1878, 1879, &end
# Atom 1: HA TYR 110, Atom 2: H ALA 111
 &rst iat=1665, 1684, r3=3.000000, r4=3.500000, &end
# Atom 1: HA TYR 110, Atom 2: H LYS 123
 &rst iat=1665, 1852, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 TYR 110, Atom 2: H ALA 111
 &rst iat=1667, 1684, r3=5.000000, r4=5.500000, &end
# Atom 1: HB2 TYR 110, Atom 2: H LYS 123
 &rst iat=1667, 1852, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 TYR 110, Atom 2: H ALA 111
 &rst iat=1668, 1684, r3=5.000000, r4=5.500000, &end
# Atom 1: HB3 TYR 110, Atom 2: H LYS 123
 &rst iat=1668, 1852, r3=6.000000, r4=6.500000, &end
# Atom 1: QD TYR 110, Atom 2: H ALA 111
 &rst iat=-1, 1684, r3=8.000000, r4=8.500000, igr1=1671, 1680, &end
# Atom 1: QD TYR 110, Atom 2: H SER 112
 &rst iat=-1, 1694, r3=8.000000, r4=8.500000, igr1=1671, 1680, &end
# Atom 1: QD TYR 110, Atom 2: QB LEU 121
 &rst iat=-1, -1, r3=8.880000, r4=9.380000, 
 igr1=1671, 1680, igr2=1821, 1822, &end
# Atom 1: QD TYR 110, Atom 2: QQD LEU 121
 &rst iat=-1, -1, r3=10.570000, r4=11.070000, 
 igr1=1671, 1680, igr2=1826, 1827, 1828, 1830, 1831, 1832, &end
# Atom 1: QD TYR 110, Atom 2: HA VAL 122
 &rst iat=-1, 1838, r3=8.000000, r4=8.500000, igr1=1671, 1680, &end
# Atom 1: QD TYR 110, Atom 2: H LYS 123
 &rst iat=-1, 1852, r3=8.000000, r4=8.500000, igr1=1671, 1680, &end
# Atom 1: QD TYR 110, Atom 2: QB LYS 123
 &rst iat=-1, -1, r3=9.000000, r4=9.500000, 
 igr1=1671, 1680, igr2=1856, 1857, &end
# Atom 1: QD TYR 110, Atom 2: HG2 LYS 123
 &rst iat=-1, 1859, r3=8.000000, r4=8.500000, igr1=1671, 1680, &end
# Atom 1: QD TYR 110, Atom 2: HG3 LYS 123
 &rst iat=-1, 1860, r3=8.000000, r4=8.500000, igr1=1671, 1680, &end
# Atom 1: QD TYR 110, Atom 2: HD2 LYS 123
 &rst iat=-1, 1862, r3=8.000000, r4=8.500000, igr1=1671, 1680, &end
# Atom 1: QD TYR 110, Atom 2: HD3 LYS 123
 &rst iat=-1, 1863, r3=8.000000, r4=8.500000, igr1=1671, 1680, &end
# Atom 1: QD TYR 110, Atom 2: QE LYS 123
 &rst iat=-1, -1, r3=8.880000, r4=9.380000, 
 igr1=1671, 1680, igr2=1865, 1866, &end
# Atom 1: QE TYR 110, Atom 2: H ALA 111
 &rst iat=-1, 1684, r3=8.000000, r4=8.500000, igr1=1673, 1678, &end
# Atom 1: QE TYR 110, Atom 2: H SER 112
 &rst iat=-1, 1694, r3=8.000000, r4=8.500000, igr1=1673, 1678, &end
# Atom 1: QE TYR 110, Atom 2: HA LEU 121
 &rst iat=-1, 1819, r3=8.000000, r4=8.500000, igr1=1673, 1678, &end
# Atom 1: QE TYR 110, Atom 2: HB2 LEU 121
 &rst iat=-1, 1821, r3=8.000000, r4=8.500000, igr1=1673, 1678, &end
# Atom 1: QE TYR 110, Atom 2: HB3 LEU 121
 &rst iat=-1, 1822, r3=8.000000, r4=8.500000, igr1=1673, 1678, &end
# Atom 1: QE TYR 110, Atom 2: HG LEU 121
 &rst iat=-1, 1824, r3=8.000000, r4=8.500000, igr1=1673, 1678, &end
# Atom 1: QE TYR 110, Atom 2: QQD LEU 121
 &rst iat=-1, -1, r3=9.070000, r4=9.570000, 
 igr1=1673, 1678, igr2=1826, 1827, 1828, 1830, 1831, 1832, &end
# Atom 1: QE TYR 110, Atom 2: HA VAL 122
 &rst iat=-1, 1838, r3=8.000000, r4=8.500000, igr1=1673, 1678, &end
# Atom 1: QE TYR 110, Atom 2: QE LYS 123
 &rst iat=-1, -1, r3=8.880000, r4=9.380000, 
 igr1=1673, 1678, igr2=1865, 1866, &end
# Atom 1: H ALA 111, Atom 2: H SER 112
 &rst iat=1684, 1694, r3=4.600000, r4=5.100000, &end
# Atom 1: H ALA 111, Atom 2: HA SER 112
 &rst iat=1684, 1696, r3=6.000000, r4=6.500000, &end
# Atom 1: H ALA 111, Atom 2: QB SER 112
 &rst iat=1684, -1, r3=7.000000, r4=7.500000, igr2=1698, 1699, &end
# Atom 1: H ALA 111, Atom 2: HA VAL 122
 &rst iat=1684, 1838, r3=6.000000, r4=6.500000, &end
# Atom 1: H ALA 111, Atom 2: QQG VAL 122
 &rst iat=1684, -1, r3=8.260000, r4=8.760000, igr2=1842, 1843, 1844, 1846, 1847, 1848, &end
# Atom 1: H ALA 111, Atom 2: H LYS 123
 &rst iat=1684, 1852, r3=5.900000, r4=6.400000, &end
# Atom 1: HA ALA 111, Atom 2: H SER 112
 &rst iat=1686, 1694, r3=3.100000, r4=3.600000, &end
# Atom 1: HA ALA 111, Atom 2: QB SER 112
 &rst iat=1686, -1, r3=5.700000, r4=6.200000, igr2=1698, 1699, &end
# Atom 1: HA ALA 111, Atom 2: H LYS 123
 &rst iat=1686, 1852, r3=4.700000, r4=5.200000, &end
# Atom 1: QB ALA 111, Atom 2: H SER 112
 &rst iat=-1, 1694, r3=4.400000, r4=4.900000, igr1=1688, 1689, 1690, &end
# Atom 1: QB ALA 111, Atom 2: QB SER 112
 &rst iat=-1, -1, r3=8.000000, r4=8.500000, 
 igr1=1688, 1689, 1690, igr2=1698, 1699, &end
# Atom 1: QB ALA 111, Atom 2: H LYS 123
 &rst iat=-1, 1852, r3=6.500000, r4=7.000000, igr1=1688, 1689, 1690, &end
# Atom 1: H SER 112, Atom 2: H VAL 113
 &rst iat=1694, 1705, r3=4.700000, r4=5.200000, &end
# Atom 1: H SER 112, Atom 2: HA VAL 113
 &rst iat=1694, 1707, r3=5.600000, r4=6.100000, &end
# Atom 1: H SER 112, Atom 2: QQG VAL 113
 &rst iat=1694, -1, r3=8.200000, r4=8.700000, igr2=1711, 1712, 1713, 1715, 1716, 1717, &end
# Atom 1: H SER 112, Atom 2: HA ALA 120
 &rst iat=1694, 1809, r3=5.900000, r4=6.400000, &end
# Atom 1: H SER 112, Atom 2: H LEU 121
 &rst iat=1694, 1817, r3=4.700000, r4=5.200000, &end
# Atom 1: H SER 112, Atom 2: HB2 LEU 121
 &rst iat=1694, 1821, r3=6.000000, r4=6.500000, &end
# Atom 1: H SER 112, Atom 2: HB3 LEU 121
 &rst iat=1694, 1822, r3=6.000000, r4=6.500000, &end
# Atom 1: H SER 112, Atom 2: QB LEU 121
 &rst iat=1694, -1, r3=5.550000, r4=6.050000, igr2=1821, 1822, &end
# Atom 1: H SER 112, Atom 2: HG LEU 121
 &rst iat=1694, 1824, r3=6.000000, r4=6.500000, &end
# Atom 1: H SER 112, Atom 2: QQD LEU 121
 &rst iat=1694, -1, r3=8.570000, r4=9.070000, igr2=1826, 1827, 1828, 1830, 1831, 1832, &end
# Atom 1: H SER 112, Atom 2: HA VAL 122
 &rst iat=1694, 1838, r3=4.900000, r4=5.400000, &end
# Atom 1: H SER 112, Atom 2: H LYS 123
 &rst iat=1694, 1852, r3=5.900000, r4=6.400000, &end
# Atom 1: H SER 112, Atom 2: QG LYS 123
 &rst iat=1694, -1, r3=6.880000, r4=7.380000, igr2=1859, 1860, &end
# Atom 1: HA SER 112, Atom 2: H VAL 113
 &rst iat=1696, 1705, r3=3.400000, r4=3.900000, &end
# Atom 1: HA SER 112, Atom 2: H LEU 121
 &rst iat=1696, 1817, r3=5.600000, r4=6.100000, &end
# Atom 1: QB SER 112, Atom 2: H LEU 121
 &rst iat=-1, 1817, r3=7.000000, r4=7.500000, igr1=1698, 1699, &end
# Atom 1: QB SER 112, Atom 2: QB LEU 121
 &rst iat=-1, -1, r3=7.880000, r4=8.380000, 
 igr1=1698, 1699, igr2=1821, 1822, &end
# Atom 1: QB SER 112, Atom 2: QD1 LEU 121
 &rst iat=-1, -1, r3=8.000000, r4=8.500000, 
 igr1=1698, 1699, igr2=1826, 1827, 1828, &end
# Atom 1: QB SER 112, Atom 2: QD2 LEU 121
 &rst iat=-1, -1, r3=8.000000, r4=8.500000, 
 igr1=1698, 1699, igr2=1830, 1831, 1832, &end
# Atom 1: H VAL 113, Atom 2: HB VAL 113
 &rst iat=1705, 1709, r3=3.800000, r4=4.300000, &end
# Atom 1: H VAL 113, Atom 2: H ALA 114
 &rst iat=1705, 1721, r3=5.300000, r4=5.800000, &end
# Atom 1: H VAL 113, Atom 2: QB ALA 114
 &rst iat=1705, -1, r3=7.000000, r4=7.500000, igr2=1725, 1726, 1727, &end
# Atom 1: H VAL 113, Atom 2: HA ALA 120
 &rst iat=1705, 1809, r3=6.000000, r4=6.500000, &end
# Atom 1: H VAL 113, Atom 2: QB ALA 120
 &rst iat=1705, -1, r3=7.000000, r4=7.500000, igr2=1811, 1812, 1813, &end
# Atom 1: H VAL 113, Atom 2: H LEU 121
 &rst iat=1705, 1817, r3=6.000000, r4=6.500000, &end
# Atom 1: HA VAL 113, Atom 2: H ALA 114
 &rst iat=1707, 1721, r3=3.200000, r4=3.700000, &end
# Atom 1: HA VAL 113, Atom 2: H ALA 120
 &rst iat=1707, 1807, r3=6.000000, r4=6.500000, &end
# Atom 1: HA VAL 113, Atom 2: H LEU 121
 &rst iat=1707, 1817, r3=5.000000, r4=5.500000, &end
# Atom 1: HB VAL 113, Atom 2: H ALA 114
 &rst iat=1709, 1721, r3=4.900000, r4=5.400000, &end
# Atom 1: QQG VAL 113, Atom 2: H ALA 114
 &rst iat=-1, 1721, r3=8.400000, r4=8.900000, igr1=1711, 1712, 1713, 1715, 1716, 1717, &end
# Atom 1: QQG VAL 113, Atom 2: H SER 118
 &rst iat=-1, 1774, r3=8.400000, r4=8.900000, igr1=1711, 1712, 1713, 1715, 1716, 1717, &end
# Atom 1: QQG VAL 113, Atom 2: H LYS 119
 &rst iat=-1, 1785, r3=8.400000, r4=8.900000, igr1=1711, 1712, 1713, 1715, 1716, 1717, &end
# Atom 1: QQG VAL 113, Atom 2: H LEU 121
 &rst iat=-1, 1817, r3=8.400000, r4=8.900000, igr1=1711, 1712, 1713, 1715, 1716, 1717, &end
# Atom 1: H ALA 114, Atom 2: H LEU 115
 &rst iat=1721, 1731, r3=4.500000, r4=5.000000, &end
# Atom 1: H ALA 114, Atom 2: H THR 117
 &rst iat=1721, 1760, r3=6.000000, r4=6.500000, &end
# Atom 1: H ALA 114, Atom 2: QG THR 117
 &rst iat=1721, 1770, r3=6.400000, r4=6.900000, &end
# Atom 1: H ALA 114, Atom 2: H SER 118
 &rst iat=1721, 1774, r3=5.200000, r4=5.700000, &end
# Atom 1: H ALA 114, Atom 2: HA SER 118
 &rst iat=1721, 1776, r3=6.000000, r4=6.500000, &end
# Atom 1: H ALA 114, Atom 2: H LYS 119
 &rst iat=1721, 1785, r3=5.100000, r4=5.600000, &end
# Atom 1: H ALA 114, Atom 2: QB LYS 119
 &rst iat=1721, -1, r3=7.000000, r4=7.500000, igr2=1789, 1790, &end
# Atom 1: H ALA 114, Atom 2: QD LYS 119
 &rst iat=1721, -1, r3=6.780000, r4=7.280000, igr2=1795, 1796, &end
# Atom 1: H ALA 114, Atom 2: H ALA 120
 &rst iat=1721, 1807, r3=6.000000, r4=6.500000, &end
# Atom 1: H ALA 114, Atom 2: HA ALA 120
 &rst iat=1721, 1809, r3=4.800000, r4=5.300000, &end
# Atom 1: H ALA 114, Atom 2: H LEU 121
 &rst iat=1721, 1817, r3=5.500000, r4=6.000000, &end
# Atom 1: H ALA 114, Atom 2: QQD LEU 121
 &rst iat=1721, -1, r3=7.470000, r4=7.970000, igr2=1826, 1827, 1828, 1830, 1831, 1832, &end
# Atom 1: HA ALA 114, Atom 2: H LEU 115
 &rst iat=1723, 1731, r3=3.200000, r4=3.700000, &end
# Atom 1: HA ALA 114, Atom 2: H ALA 116
 &rst iat=1723, 1750, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ALA 114, Atom 2: H SER 118
 &rst iat=1723, 1774, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ALA 114, Atom 2: H LYS 119
 &rst iat=1723, 1785, r3=6.000000, r4=6.500000, &end
# Atom 1: QB ALA 114, Atom 2: H LEU 115
 &rst iat=-1, 1731, r3=4.400000, r4=4.900000, igr1=1725, 1726, 1727, &end
# Atom 1: QB ALA 114, Atom 2: H ALA 116
 &rst iat=-1, 1750, r3=5.200000, r4=5.700000, igr1=1725, 1726, 1727, &end
# Atom 1: QB ALA 114, Atom 2: H THR 117
 &rst iat=-1, 1760, r3=5.000000, r4=5.500000, igr1=1725, 1726, 1727, &end
# Atom 1: QB ALA 114, Atom 2: H SER 118
 &rst iat=-1, 1774, r3=5.000000, r4=5.500000, igr1=1725, 1726, 1727, &end
# Atom 1: QB ALA 114, Atom 2: H LYS 119
 &rst iat=-1, 1785, r3=7.000000, r4=7.500000, igr1=1725, 1726, 1727, &end
# Atom 1: QB ALA 114, Atom 2: H LEU 121
 &rst iat=-1, 1817, r3=7.000000, r4=7.500000, igr1=1725, 1726, 1727, &end
# Atom 1: H LEU 115, Atom 2: QB LEU 115
 &rst iat=1731, -1, r3=3.850000, r4=4.350000, igr2=1735, 1736, &end
# Atom 1: H LEU 115, Atom 2: HG LEU 115
 &rst iat=1731, 1738, r3=3.600000, r4=4.100000, &end
# Atom 1: H LEU 115, Atom 2: QD1 LEU 115
 &rst iat=1731, -1, r3=5.000000, r4=5.500000, igr2=1740, 1741, 1742, &end
# Atom 1: H LEU 115, Atom 2: QD2 LEU 115
 &rst iat=1731, -1, r3=5.000000, r4=5.500000, igr2=1744, 1745, 1746, &end
# Atom 1: H LEU 115, Atom 2: H ALA 116
 &rst iat=1731, 1750, r3=3.700000, r4=4.200000, &end
# Atom 1: H LEU 115, Atom 2: HA ALA 116
 &rst iat=1731, 1752, r3=5.400000, r4=5.900000, &end
# Atom 1: H LEU 115, Atom 2: H THR 117
 &rst iat=1731, 1760, r3=5.100000, r4=5.600000, &end
# Atom 1: H LEU 115, Atom 2: QG THR 117
 &rst iat=1731, 1770, r3=7.000000, r4=7.500000, &end
# Atom 1: H LEU 115, Atom 2: H SER 118
 &rst iat=1731, 1774, r3=6.000000, r4=6.500000, &end
# Atom 1: H LEU 115, Atom 2: H LYS 119
 &rst iat=1731, 1785, r3=6.000000, r4=6.500000, &end
# Atom 1: HA LEU 115, Atom 2: H THR 117
 &rst iat=1733, 1760, r3=5.300000, r4=5.800000, &end
# Atom 1: QB LEU 115, Atom 2: H ALA 116
 &rst iat=-1, 1750, r3=4.980000, r4=5.480000, igr1=1735, 1736, &end
# Atom 1: QB LEU 115, Atom 2: H THR 117
 &rst iat=-1, 1760, r3=6.880000, r4=7.380000, igr1=1735, 1736, &end
# Atom 1: QD1 LEU 115, Atom 2: H ALA 116
 &rst iat=-1, 1750, r3=7.000000, r4=7.500000, igr1=1740, 1741, 1742, &end
# Atom 1: QD2 LEU 115, Atom 2: H ALA 116
 &rst iat=-1, 1750, r3=7.000000, r4=7.500000, igr1=1744, 1745, 1746, &end
# Atom 1: QQD LEU 115, Atom 2: H THR 117
 &rst iat=-1, 1760, r3=8.570000, r4=9.070000, igr1=1740, 1741, 1742, 1744, 1745, 1746, &end
# Atom 1: QQD LEU 115, Atom 2: H SER 118
 &rst iat=-1, 1774, r3=8.570000, r4=9.070000, igr1=1740, 1741, 1742, 1744, 1745, 1746, &end
# Atom 1: H ALA 116, Atom 2: H THR 117
 &rst iat=1750, 1760, r3=4.500000, r4=5.000000, &end
# Atom 1: H ALA 116, Atom 2: HB THR 117
 &rst iat=1750, 1764, r3=5.700000, r4=6.200000, &end
# Atom 1: H ALA 116, Atom 2: QG THR 117
 &rst iat=1750, 1770, r3=7.000000, r4=7.500000, &end
# Atom 1: H ALA 116, Atom 2: H SER 118
 &rst iat=1750, 1774, r3=4.700000, r4=5.200000, &end
# Atom 1: HA ALA 116, Atom 2: H SER 118
 &rst iat=1752, 1774, r3=5.300000, r4=5.800000, &end
# Atom 1: QB ALA 116, Atom 2: H THR 117
 &rst iat=-1, 1760, r3=4.400000, r4=4.900000, igr1=1754, 1755, 1756, &end
# Atom 1: QB ALA 116, Atom 2: H SER 118
 &rst iat=-1, 1774, r3=5.600000, r4=6.100000, igr1=1754, 1755, 1756, &end
# Atom 1: H THR 117, Atom 2: QG THR 117
 &rst iat=1760, 1770, r3=4.600000, r4=5.100000, &end
# Atom 1: H THR 117, Atom 2: H SER 118
 &rst iat=1760, 1774, r3=3.200000, r4=3.700000, &end
# Atom 1: H THR 117, Atom 2: HA SER 118
 &rst iat=1760, 1776, r3=4.500000, r4=5.000000, &end
# Atom 1: H THR 117, Atom 2: H LYS 119
 &rst iat=1760, 1785, r3=5.100000, r4=5.600000, &end
# Atom 1: HB THR 117, Atom 2: H SER 118
 &rst iat=1764, 1774, r3=4.900000, r4=5.400000, &end
# Atom 1: HB THR 117, Atom 2: H LYS 119
 &rst iat=1764, 1785, r3=4.900000, r4=5.400000, &end
# Atom 1: QG THR 117, Atom 2: H SER 118
 &rst iat=1770, 1774, r3=6.600000, r4=7.100000, &end
# Atom 1: QG THR 117, Atom 2: H LYS 119
 &rst iat=1770, 1785, r3=6.800000, r4=7.300000, &end
# Atom 1: H SER 118, Atom 2: H LYS 119
 &rst iat=1774, 1785, r3=3.500000, r4=4.000000, &end
# Atom 1: H SER 118, Atom 2: HA LYS 119
 &rst iat=1774, 1787, r3=5.400000, r4=5.900000, &end
# Atom 1: H SER 118, Atom 2: QB LYS 119
 &rst iat=1774, -1, r3=6.100000, r4=6.600000, igr2=1789, 1790, &end
# Atom 1: HA SER 118, Atom 2: H LYS 119
 &rst iat=1776, 1785, r3=3.600000, r4=4.100000, &end
# Atom 1: HB2 SER 118, Atom 2: H LYS 119
 &rst iat=1778, 1785, r3=4.800000, r4=5.300000, &end
# Atom 1: HB3 SER 118, Atom 2: H LYS 119
 &rst iat=1779, 1785, r3=4.800000, r4=5.300000, &end
# Atom 1: QB SER 118, Atom 2: H LYS 119
 &rst iat=-1, 1785, r3=4.520000, r4=5.020000, igr1=1778, 1779, &end
# Atom 1: H LYS 119, Atom 2: HG2 LYS 119
 &rst iat=1785, 1792, r3=3.500000, r4=4.000000, &end
# Atom 1: H LYS 119, Atom 2: HG3 LYS 119
 &rst iat=1785, 1793, r3=3.500000, r4=4.000000, &end
# Atom 1: H LYS 119, Atom 2: QD LYS 119
 &rst iat=1785, -1, r3=4.780000, r4=5.280000, igr2=1795, 1796, &end
# Atom 1: H LYS 119, Atom 2: QE LYS 119
 &rst iat=1785, -1, r3=6.800000, r4=7.300000, igr2=1798, 1799, &end
# Atom 1: H LYS 119, Atom 2: H ALA 120
 &rst iat=1785, 1807, r3=4.900000, r4=5.400000, &end
# Atom 1: QB LYS 119, Atom 2: H ALA 120
 &rst iat=-1, 1807, r3=5.000000, r4=5.500000, igr1=1789, 1790, &end
# Atom 1: HG2 LYS 119, Atom 2: H ALA 120
 &rst iat=1792, 1807, r3=5.500000, r4=6.000000, &end
# Atom 1: HG3 LYS 119, Atom 2: H ALA 120
 &rst iat=1793, 1807, r3=5.500000, r4=6.000000, &end
# Atom 1: QG LYS 119, Atom 2: H ALA 120
 &rst iat=-1, 1807, r3=5.280000, r4=5.780000, igr1=1792, 1793, &end
# Atom 1: QE LYS 119, Atom 2: H ALA 120
 &rst iat=-1, 1807, r3=7.000000, r4=7.500000, igr1=1798, 1799, &end
# Atom 1: QE LYS 119, Atom 2: H ALA 148
 &rst iat=-1, 2261, r3=7.000000, r4=7.500000, igr1=1798, 1799, &end
# Atom 1: QE LYS 119, Atom 2: H GLN 149
 &rst iat=-1, 2271, r3=7.000000, r4=7.500000, igr1=1798, 1799, &end
# Atom 1: H ALA 120, Atom 2: H LEU 121
 &rst iat=1807, 1817, r3=5.100000, r4=5.600000, &end
# Atom 1: H ALA 120, Atom 2: HA LEU 121
 &rst iat=1807, 1819, r3=6.000000, r4=6.500000, &end
# Atom 1: H ALA 120, Atom 2: QQD LEU 121
 &rst iat=1807, -1, r3=8.570000, r4=9.070000, igr2=1826, 1827, 1828, 1830, 1831, 1832, &end
# Atom 1: HA ALA 120, Atom 2: H LEU 121
 &rst iat=1809, 1817, r3=3.300000, r4=3.800000, &end
# Atom 1: QB ALA 120, Atom 2: H VAL 122
 &rst iat=-1, 1836, r3=6.500000, r4=7.000000, igr1=1811, 1812, 1813, &end
# Atom 1: H LEU 121, Atom 2: HB2 LEU 121
 &rst iat=1817, 1821, r3=3.900000, r4=4.400000, &end
# Atom 1: H LEU 121, Atom 2: HB3 LEU 121
 &rst iat=1817, 1822, r3=3.900000, r4=4.400000, &end
# Atom 1: H LEU 121, Atom 2: HG LEU 121
 &rst iat=1817, 1824, r3=4.200000, r4=4.700000, &end
# Atom 1: H LEU 121, Atom 2: QQD LEU 121
 &rst iat=1817, -1, r3=6.670000, r4=7.170000, igr2=1826, 1827, 1828, 1830, 1831, 1832, &end
# Atom 1: HA LEU 121, Atom 2: H VAL 122
 &rst iat=1819, 1836, r3=3.300000, r4=3.800000, &end
# Atom 1: QB LEU 121, Atom 2: H VAL 122
 &rst iat=-1, 1836, r3=4.480000, r4=4.980000, igr1=1821, 1822, &end
# Atom 1: HG LEU 121, Atom 2: H VAL 122
 &rst iat=1824, 1836, r3=6.000000, r4=6.500000, &end
# Atom 1: QQD LEU 121, Atom 2: H VAL 122
 &rst iat=-1, 1836, r3=7.270000, r4=7.770000, igr1=1826, 1827, 1828, 1830, 1831, 1832, &end
# Atom 1: QQD LEU 121, Atom 2: H LYS 123
 &rst iat=-1, 1852, r3=8.570000, r4=9.070000, igr1=1826, 1827, 1828, 1830, 1831, 1832, &end
# Atom 1: H VAL 122, Atom 2: HB VAL 122
 &rst iat=1836, 1840, r3=3.800000, r4=4.300000, &end
# Atom 1: H VAL 122, Atom 2: H LYS 123
 &rst iat=1836, 1852, r3=5.000000, r4=5.500000, &end
# Atom 1: H VAL 122, Atom 2: HA LYS 123
 &rst iat=1836, 1854, r3=5.900000, r4=6.400000, &end
# Atom 1: H VAL 122, Atom 2: QD PHE 124
 &rst iat=1836, -1, r3=8.000000, r4=8.500000, igr2=1882, 1890, &end
# Atom 1: H VAL 122, Atom 2: QE PHE 124
 &rst iat=1836, -1, r3=8.000000, r4=8.500000, igr2=1884, 1888, &end
# Atom 1: HA VAL 122, Atom 2: H LYS 123
 &rst iat=1838, 1852, r3=3.400000, r4=3.900000, &end
# Atom 1: HA VAL 122, Atom 2: H PHE 124
 &rst iat=1838, 1874, r3=6.000000, r4=6.500000, &end
# Atom 1: QG1 VAL 122, Atom 2: H LYS 123
 &rst iat=-1, 1852, r3=6.000000, r4=6.500000, igr1=1842, 1843, 1844, &end
# Atom 1: QG1 VAL 122, Atom 2: H PHE 124
 &rst iat=-1, 1874, r3=7.000000, r4=7.500000, igr1=1842, 1843, 1844, &end
# Atom 1: QG2 VAL 122, Atom 2: H LYS 123
 &rst iat=-1, 1852, r3=6.000000, r4=6.500000, igr1=1846, 1847, 1848, &end
# Atom 1: QG2 VAL 122, Atom 2: H PHE 124
 &rst iat=-1, 1874, r3=7.000000, r4=7.500000, igr1=1846, 1847, 1848, &end
# Atom 1: QQG VAL 122, Atom 2: H LYS 123
 &rst iat=-1, 1852, r3=5.490000, r4=5.990000, igr1=1842, 1843, 1844, 1846, 1847, 1848, &end
# Atom 1: H LYS 123, Atom 2: HG2 LYS 123
 &rst iat=1852, 1859, r3=5.100000, r4=5.600000, &end
# Atom 1: H LYS 123, Atom 2: HG3 LYS 123
 &rst iat=1852, 1860, r3=5.100000, r4=5.600000, &end
# Atom 1: H LYS 123, Atom 2: QG LYS 123
 &rst iat=1852, -1, r3=4.780000, r4=5.280000, igr2=1859, 1860, &end
# Atom 1: H LYS 123, Atom 2: HD2 LYS 123
 &rst iat=1852, 1862, r3=4.900000, r4=5.400000, &end
# Atom 1: H LYS 123, Atom 2: HD3 LYS 123
 &rst iat=1852, 1863, r3=4.900000, r4=5.400000, &end
# Atom 1: H LYS 123, Atom 2: HE2 LYS 123
 &rst iat=1852, 1865, r3=6.000000, r4=6.500000, &end
# Atom 1: H LYS 123, Atom 2: HE3 LYS 123
 &rst iat=1852, 1866, r3=6.000000, r4=6.500000, &end
# Atom 1: H LYS 123, Atom 2: QE LYS 123
 &rst iat=1852, -1, r3=5.500000, r4=6.000000, igr2=1865, 1866, &end
# Atom 1: H LYS 123, Atom 2: H PHE 124
 &rst iat=1852, 1874, r3=4.600000, r4=5.100000, &end
# Atom 1: H LYS 123, Atom 2: HA PHE 124
 &rst iat=1852, 1876, r3=5.000000, r4=5.500000, &end
# Atom 1: H LYS 123, Atom 2: QB PHE 124
 &rst iat=1852, -1, r3=7.000000, r4=7.500000, igr2=1878, 1879, &end
# Atom 1: H LYS 123, Atom 2: QD PHE 124
 &rst iat=1852, -1, r3=8.000000, r4=8.500000, igr2=1882, 1890, &end
# Atom 1: HA LYS 123, Atom 2: H PHE 124
 &rst iat=1854, 1874, r3=3.300000, r4=3.800000, &end
# Atom 1: QB LYS 123, Atom 2: H PHE 124
 &rst iat=-1, 1874, r3=5.400000, r4=5.900000, igr1=1856, 1857, &end
# Atom 1: HG2 LYS 123, Atom 2: H PHE 124
 &rst iat=1859, 1874, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 LYS 123, Atom 2: H PHE 124
 &rst iat=1860, 1874, r3=6.000000, r4=6.500000, &end
# Atom 1: QD LYS 123, Atom 2: H PHE 124
 &rst iat=-1, 1874, r3=6.880000, r4=7.380000, igr1=1862, 1863, &end
# Atom 1: HE2 LYS 123, Atom 2: H PHE 124
 &rst iat=1865, 1874, r3=6.000000, r4=6.500000, &end
# Atom 1: HE3 LYS 123, Atom 2: H PHE 124
 &rst iat=1866, 1874, r3=6.000000, r4=6.500000, &end
# Atom 1: H PHE 124, Atom 2: QE PHE 124
 &rst iat=1874, -1, r3=6.600000, r4=7.100000, igr2=1884, 1888, &end
# Atom 1: H PHE 124, Atom 2: H ASP 125
 &rst iat=1874, 1894, r3=4.700000, r4=5.200000, &end
# Atom 1: H PHE 124, Atom 2: QD PRO 126
 &rst iat=1874, -1, r3=6.880000, r4=7.380000, igr2=1907, 1908, &end
# Atom 1: H PHE 124, Atom 2: QD ILE 134
 &rst iat=1874, -1, r3=7.000000, r4=7.500000, igr2=2043, 2044, 2045, &end
# Atom 1: HA PHE 124, Atom 2: H ASP 125
 &rst iat=1876, 1894, r3=3.600000, r4=4.100000, &end
# Atom 1: QB PHE 124, Atom 2: H GLU 127
 &rst iat=-1, 1920, r3=7.000000, r4=7.500000, igr1=1878, 1879, &end
# Atom 1: QB PHE 124, Atom 2: H ILE 129
 &rst iat=-1, 1954, r3=7.000000, r4=7.500000, igr1=1878, 1879, &end
# Atom 1: QD PHE 124, Atom 2: H ASP 125
 &rst iat=-1, 1894, r3=8.000000, r4=8.500000, igr1=1882, 1890, &end
# Atom 1: QD PHE 124, Atom 2: H GLU 127
 &rst iat=-1, 1920, r3=8.000000, r4=8.500000, igr1=1882, 1890, &end
# Atom 1: QD PHE 124, Atom 2: H ILE 128
 &rst iat=-1, 1935, r3=8.000000, r4=8.500000, igr1=1882, 1890, &end
# Atom 1: QD PHE 124, Atom 2: H ILE 129
 &rst iat=-1, 1954, r3=8.000000, r4=8.500000, igr1=1882, 1890, &end
# Atom 1: QD PHE 124, Atom 2: H GLY 130
 &rst iat=-1, 1973, r3=8.000000, r4=8.500000, igr1=1882, 1890, &end
# Atom 1: QE PHE 124, Atom 2: H ASP 125
 &rst iat=-1, 1894, r3=8.000000, r4=8.500000, igr1=1884, 1888, &end
# Atom 1: QE PHE 124, Atom 2: H GLU 127
 &rst iat=-1, 1920, r3=8.000000, r4=8.500000, igr1=1884, 1888, &end
# Atom 1: H ASP 125, Atom 2: HB2 ASP 125
 &rst iat=1894, 1898, r3=3.800000, r4=4.300000, &end
# Atom 1: H ASP 125, Atom 2: HB3 ASP 125
 &rst iat=1894, 1899, r3=3.800000, r4=4.300000, &end
# Atom 1: H ASP 125, Atom 2: HD2 PRO 126
 &rst iat=1894, 1907, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASP 125, Atom 2: HD3 PRO 126
 &rst iat=1894, 1908, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASP 125, Atom 2: H ILE 128
 &rst iat=1894, 1935, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASP 125, Atom 2: HB ILE 128
 &rst iat=1894, 1939, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASP 125, Atom 2: QG1 ILE 128
 &rst iat=1894, -1, r3=6.680000, r4=7.180000, igr2=1945, 1946, &end
# Atom 1: H ASP 125, Atom 2: H ILE 129
 &rst iat=1894, 1954, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASP 125, Atom 2: QG2 ILE 129
 &rst iat=1894, -1, r3=5.700000, r4=6.200000, igr2=1960, 1961, 1962, &end
# Atom 1: HA ASP 125, Atom 2: H GLU 127
 &rst iat=1896, 1920, r3=5.200000, r4=5.700000, &end
# Atom 1: HA ASP 125, Atom 2: H ILE 128
 &rst iat=1896, 1935, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 ASP 125, Atom 2: H GLU 127
 &rst iat=1898, 1920, r3=5.800000, r4=6.300000, &end
# Atom 1: HB2 ASP 125, Atom 2: H ILE 128
 &rst iat=1898, 1935, r3=5.900000, r4=6.400000, &end
# Atom 1: HB3 ASP 125, Atom 2: H GLU 127
 &rst iat=1899, 1920, r3=5.800000, r4=6.300000, &end
# Atom 1: HB3 ASP 125, Atom 2: H ILE 128
 &rst iat=1899, 1935, r3=5.900000, r4=6.400000, &end
# Atom 1: QB ASP 125, Atom 2: H GLU 127
 &rst iat=-1, 1920, r3=5.630000, r4=6.130000, igr1=1898, 1899, &end
# Atom 1: QB ASP 125, Atom 2: H ILE 128
 &rst iat=-1, 1935, r3=5.640000, r4=6.140000, igr1=1898, 1899, &end
# Atom 1: QB ASP 125, Atom 2: H ILE 129
 &rst iat=-1, 1954, r3=6.880000, r4=7.380000, igr1=1898, 1899, &end
# Atom 1: HA PRO 126, Atom 2: H ILE 128
 &rst iat=1916, 1935, r3=5.600000, r4=6.100000, &end
# Atom 1: HA PRO 126, Atom 2: H ILE 129
 &rst iat=1916, 1954, r3=4.800000, r4=5.300000, &end
# Atom 1: QB PRO 126, Atom 2: H GLU 127
 &rst iat=-1, 1920, r3=4.400000, r4=4.900000, igr1=1913, 1914, &end
# Atom 1: HD2 PRO 126, Atom 2: H GLU 127
 &rst iat=1907, 1920, r3=5.700000, r4=6.200000, &end
# Atom 1: HD3 PRO 126, Atom 2: H GLU 127
 &rst iat=1908, 1920, r3=5.700000, r4=6.200000, &end
# Atom 1: QD PRO 126, Atom 2: H ILE 128
 &rst iat=-1, 1935, r3=6.880000, r4=7.380000, igr1=1907, 1908, &end
# Atom 1: H GLU 127, Atom 2: HG2 GLU 127
 &rst iat=1920, 1927, r3=4.300000, r4=4.800000, &end
# Atom 1: H GLU 127, Atom 2: HG3 GLU 127
 &rst iat=1920, 1928, r3=4.300000, r4=4.800000, &end
# Atom 1: H GLU 127, Atom 2: QG GLU 127
 &rst iat=1920, -1, r3=3.910000, r4=4.410000, igr2=1927, 1928, &end
# Atom 1: H GLU 127, Atom 2: H ILE 128
 &rst iat=1920, 1935, r3=3.300000, r4=3.800000, &end
# Atom 1: H GLU 127, Atom 2: HA ILE 128
 &rst iat=1920, 1937, r3=4.400000, r4=4.900000, &end
# Atom 1: H GLU 127, Atom 2: HG12 ILE 128
 &rst iat=1920, 1945, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLU 127, Atom 2: HG13 ILE 128
 &rst iat=1920, 1946, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLU 127, Atom 2: QD ILE 128
 &rst iat=1920, -1, r3=7.000000, r4=7.500000, igr2=1948, 1949, 1950, &end
# Atom 1: H GLU 127, Atom 2: HA ILE 129
 &rst iat=1920, 1956, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 GLU 127, Atom 2: H ILE 128
 &rst iat=1927, 1935, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLU 127, Atom 2: H ILE 128
 &rst iat=1928, 1935, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 128, Atom 2: HB ILE 128
 &rst iat=1935, 1939, r3=3.600000, r4=4.100000, &end
# Atom 1: H ILE 128, Atom 2: QG2 ILE 128
 &rst iat=1935, -1, r3=4.800000, r4=5.300000, igr2=1941, 1942, 1943, &end
# Atom 1: H ILE 128, Atom 2: HG12 ILE 128
 &rst iat=1935, 1945, r3=4.300000, r4=4.800000, &end
# Atom 1: H ILE 128, Atom 2: HG13 ILE 128
 &rst iat=1935, 1946, r3=4.300000, r4=4.800000, &end
# Atom 1: H ILE 128, Atom 2: QD ILE 128
 &rst iat=1935, -1, r3=4.200000, r4=4.700000, igr2=1948, 1949, 1950, &end
# Atom 1: H ILE 128, Atom 2: H ILE 129
 &rst iat=1935, 1954, r3=3.100000, r4=3.600000, &end
# Atom 1: H ILE 128, Atom 2: HA ILE 129
 &rst iat=1935, 1956, r3=5.000000, r4=5.500000, &end
# Atom 1: H ILE 128, Atom 2: HB ILE 129
 &rst iat=1935, 1958, r3=4.900000, r4=5.400000, &end
# Atom 1: H ILE 128, Atom 2: QG2 ILE 129
 &rst iat=1935, -1, r3=5.800000, r4=6.300000, igr2=1960, 1961, 1962, &end
# Atom 1: HB ILE 128, Atom 2: H ILE 129
 &rst iat=1939, 1954, r3=3.600000, r4=4.100000, &end
# Atom 1: HG12 ILE 128, Atom 2: H ILE 129
 &rst iat=1945, 1954, r3=6.000000, r4=6.500000, &end
# Atom 1: HG13 ILE 128, Atom 2: H ILE 129
 &rst iat=1946, 1954, r3=6.000000, r4=6.500000, &end
# Atom 1: QG1 ILE 128, Atom 2: H ILE 129
 &rst iat=-1, 1954, r3=5.840000, r4=6.340000, igr1=1945, 1946, &end
# Atom 1: QG1 ILE 128, Atom 2: H GLY 130
 &rst iat=-1, 1973, r3=6.880000, r4=7.380000, igr1=1945, 1946, &end
# Atom 1: QD ILE 128, Atom 2: H ILE 129
 &rst iat=-1, 1954, r3=5.400000, r4=5.900000, igr1=1948, 1949, 1950, &end
# Atom 1: H ILE 129, Atom 2: HB ILE 129
 &rst iat=1954, 1958, r3=3.900000, r4=4.400000, &end
# Atom 1: H ILE 129, Atom 2: QG1 ILE 129
 &rst iat=1954, -1, r3=5.680000, r4=6.180000, igr2=1964, 1965, &end
# Atom 1: H ILE 129, Atom 2: QD ILE 129
 &rst iat=1954, -1, r3=6.300000, r4=6.800000, igr2=1967, 1968, 1969, &end
# Atom 1: HA ILE 129, Atom 2: H GLY 130
 &rst iat=1956, 1973, r3=3.400000, r4=3.900000, &end
# Atom 1: HB ILE 129, Atom 2: H GLY 130
 &rst iat=1958, 1973, r3=4.100000, r4=4.600000, &end
# Atom 1: QG2 ILE 129, Atom 2: H GLY 130
 &rst iat=-1, 1973, r3=6.000000, r4=6.500000, igr1=1960, 1961, 1962, &end
# Atom 1: QG2 ILE 129, Atom 2: H ASP 133
 &rst iat=-1, 2018, r3=6.200000, r4=6.700000, igr1=1960, 1961, 1962, &end
# Atom 1: QG1 ILE 129, Atom 2: H GLY 130
 &rst iat=-1, 1973, r3=6.380000, r4=6.880000, igr1=1964, 1965, &end
# Atom 1: QG1 ILE 129, Atom 2: H ASP 133
 &rst iat=-1, 2018, r3=6.880000, r4=7.380000, igr1=1964, 1965, &end
# Atom 1: QD ILE 129, Atom 2: H ILE 134
 &rst iat=-1, 2030, r3=6.400000, r4=6.900000, igr1=1967, 1968, 1969, &end
# Atom 1: H GLY 130, Atom 2: HD2 PRO 131
 &rst iat=1973, 1981, r3=5.600000, r4=6.100000, &end
# Atom 1: H GLY 130, Atom 2: HD3 PRO 131
 &rst iat=1973, 1982, r3=5.600000, r4=6.100000, &end
# Atom 1: H GLY 130, Atom 2: QD PRO 131
 &rst iat=1973, -1, r3=5.240000, r4=5.740000, igr2=1981, 1982, &end
# Atom 1: H GLY 130, Atom 2: H ARG 132
 &rst iat=1973, 1994, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 130, Atom 2: H ASP 133
 &rst iat=1973, 2018, r3=4.900000, r4=5.400000, &end
# Atom 1: H GLY 130, Atom 2: HB2 ASP 133
 &rst iat=1973, 2022, r3=4.500000, r4=5.000000, &end
# Atom 1: H GLY 130, Atom 2: HB3 ASP 133
 &rst iat=1973, 2023, r3=4.500000, r4=5.000000, &end
# Atom 1: H GLY 130, Atom 2: QB ASP 133
 &rst iat=1973, -1, r3=4.310000, r4=4.810000, igr2=2022, 2023, &end
# Atom 1: H GLY 130, Atom 2: H ILE 134
 &rst iat=1973, 2030, r3=5.100000, r4=5.600000, &end
# Atom 1: H GLY 130, Atom 2: HG12 ILE 134
 &rst iat=1973, 2040, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 130, Atom 2: HG13 ILE 134
 &rst iat=1973, 2041, r3=6.000000, r4=6.500000, &end
# Atom 1: H GLY 130, Atom 2: QD ILE 134
 &rst iat=1973, -1, r3=7.000000, r4=7.500000, igr2=2043, 2044, 2045, &end
# Atom 1: QA GLY 130, Atom 2: H ARG 132
 &rst iat=-1, 1994, r3=5.580000, r4=6.080000, igr1=1975, 1976, &end
# Atom 1: QA GLY 130, Atom 2: H ASP 133
 &rst iat=-1, 2018, r3=6.480000, r4=6.980000, igr1=1975, 1976, &end
# Atom 1: HA PRO 131, Atom 2: H ASP 133
 &rst iat=1990, 2018, r3=5.900000, r4=6.400000, &end
# Atom 1: HA PRO 131, Atom 2: H ILE 134
 &rst iat=1990, 2030, r3=4.900000, r4=5.400000, &end
# Atom 1: HA PRO 131, Atom 2: H ILE 135
 &rst iat=1990, 2049, r3=4.900000, r4=5.400000, &end
# Atom 1: HB2 PRO 131, Atom 2: H ARG 132
 &rst iat=1987, 1994, r3=4.200000, r4=4.700000, &end
# Atom 1: HB3 PRO 131, Atom 2: H ARG 132
 &rst iat=1988, 1994, r3=4.200000, r4=4.700000, &end
# Atom 1: QB PRO 131, Atom 2: H ARG 132
 &rst iat=-1, 1994, r3=3.960000, r4=4.460000, igr1=1987, 1988, &end
# Atom 1: HD2 PRO 131, Atom 2: H ARG 132
 &rst iat=1981, 1994, r3=5.200000, r4=5.700000, &end
# Atom 1: HD3 PRO 131, Atom 2: H ARG 132
 &rst iat=1982, 1994, r3=5.200000, r4=5.700000, &end
# Atom 1: H ARG 132, Atom 2: QB ARG 132
 &rst iat=1994, -1, r3=3.770000, r4=4.270000, igr2=1998, 1999, &end
# Atom 1: H ARG 132, Atom 2: HG2 ARG 132
 &rst iat=1994, 2001, r3=4.200000, r4=4.700000, &end
# Atom 1: H ARG 132, Atom 2: HG3 ARG 132
 &rst iat=1994, 2002, r3=4.200000, r4=4.700000, &end
# Atom 1: H ARG 132, Atom 2: QG ARG 132
 &rst iat=1994, -1, r3=3.810000, r4=4.310000, igr2=2001, 2002, &end
# Atom 1: H ARG 132, Atom 2: QD ARG 132
 &rst iat=1994, -1, r3=6.700000, r4=7.200000, igr2=2004, 2005, &end
# Atom 1: H ARG 132, Atom 2: H ASP 133
 &rst iat=1994, 2018, r3=3.600000, r4=4.100000, &end
# Atom 1: H ARG 132, Atom 2: HA ASP 133
 &rst iat=1994, 2020, r3=5.700000, r4=6.200000, &end
# Atom 1: H ARG 132, Atom 2: QB ASP 133
 &rst iat=1994, -1, r3=6.580000, r4=7.080000, igr2=2022, 2023, &end
# Atom 1: H ARG 132, Atom 2: H ILE 134
 &rst iat=1994, 2030, r3=4.700000, r4=5.200000, &end
# Atom 1: H ARG 132, Atom 2: QD ILE 134
 &rst iat=1994, -1, r3=7.000000, r4=7.500000, igr2=2043, 2044, 2045, &end
# Atom 1: H ARG 132, Atom 2: H ILE 135
 &rst iat=1994, 2049, r3=6.000000, r4=6.500000, &end
# Atom 1: H ARG 132, Atom 2: QG2 ILE 135
 &rst iat=1994, -1, r3=7.000000, r4=7.500000, igr2=2055, 2056, 2057, &end
# Atom 1: H ARG 132, Atom 2: QD ILE 135
 &rst iat=1994, -1, r3=7.000000, r4=7.500000, igr2=2062, 2063, 2064, &end
# Atom 1: H ARG 132, Atom 2: H LYS 136
 &rst iat=1994, 2068, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ARG 132, Atom 2: H ILE 134
 &rst iat=1996, 2030, r3=4.400000, r4=4.900000, &end
# Atom 1: HA ARG 132, Atom 2: H ILE 135
 &rst iat=1996, 2049, r3=4.900000, r4=5.400000, &end
# Atom 1: HA ARG 132, Atom 2: H LYS 136
 &rst iat=1996, 2068, r3=5.100000, r4=5.600000, &end
# Atom 1: HG2 ARG 132, Atom 2: H ASP 133
 &rst iat=2001, 2018, r3=5.400000, r4=5.900000, &end
# Atom 1: HG2 ARG 132, Atom 2: H LYS 136
 &rst iat=2001, 2068, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 ARG 132, Atom 2: H ASP 133
 &rst iat=2002, 2018, r3=5.400000, r4=5.900000, &end
# Atom 1: HG3 ARG 132, Atom 2: H LYS 136
 &rst iat=2002, 2068, r3=6.000000, r4=6.500000, &end
# Atom 1: QG ARG 132, Atom 2: H ASP 133
 &rst iat=-1, 2018, r3=5.130000, r4=5.630000, igr1=2001, 2002, &end
# Atom 1: QG ARG 132, Atom 2: H LYS 136
 &rst iat=-1, 2068, r3=5.790000, r4=6.290000, igr1=2001, 2002, &end
# Atom 1: QD ARG 132, Atom 2: H ASP 133
 &rst iat=-1, 2018, r3=7.000000, r4=7.500000, igr1=2004, 2005, &end
# Atom 1: QD ARG 132, Atom 2: H LYS 136
 &rst iat=-1, 2068, r3=7.000000, r4=7.500000, igr1=2004, 2005, &end
# Atom 1: H ASP 133, Atom 2: HB2 ASP 133
 &rst iat=2018, 2022, r3=3.800000, r4=4.300000, &end
# Atom 1: H ASP 133, Atom 2: HB3 ASP 133
 &rst iat=2018, 2023, r3=3.800000, r4=4.300000, &end
# Atom 1: H ASP 133, Atom 2: QB ASP 133
 &rst iat=2018, -1, r3=3.600000, r4=4.100000, igr2=2022, 2023, &end
# Atom 1: H ASP 133, Atom 2: HA ILE 134
 &rst iat=2018, 2032, r3=5.300000, r4=5.800000, &end
# Atom 1: H ASP 133, Atom 2: HG12 ILE 134
 &rst iat=2018, 2040, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASP 133, Atom 2: HG13 ILE 134
 &rst iat=2018, 2041, r3=6.000000, r4=6.500000, &end
# Atom 1: H ASP 133, Atom 2: QD ILE 134
 &rst iat=2018, -1, r3=7.000000, r4=7.500000, igr2=2043, 2044, 2045, &end
# Atom 1: H ASP 133, Atom 2: H ILE 135
 &rst iat=2018, 2049, r3=4.900000, r4=5.400000, &end
# Atom 1: H ASP 133, Atom 2: H LYS 136
 &rst iat=2018, 2068, r3=5.200000, r4=5.700000, &end
# Atom 1: H ASP 133, Atom 2: H ILE 137
 &rst iat=2018, 2090, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ASP 133, Atom 2: H ILE 135
 &rst iat=2020, 2049, r3=5.000000, r4=5.500000, &end
# Atom 1: HA ASP 133, Atom 2: H LYS 136
 &rst iat=2020, 2068, r3=4.600000, r4=5.100000, &end
# Atom 1: HA ASP 133, Atom 2: H ILE 137
 &rst iat=2020, 2090, r3=4.700000, r4=5.200000, &end
# Atom 1: HB2 ASP 133, Atom 2: H ILE 134
 &rst iat=2022, 2030, r3=5.000000, r4=5.500000, &end
# Atom 1: HB3 ASP 133, Atom 2: H ILE 134
 &rst iat=2023, 2030, r3=5.000000, r4=5.500000, &end
# Atom 1: QB ASP 133, Atom 2: H ILE 134
 &rst iat=-1, 2030, r3=4.490000, r4=4.990000, igr1=2022, 2023, &end
# Atom 1: QB ASP 133, Atom 2: H LYS 136
 &rst iat=-1, 2068, r3=6.780000, r4=7.280000, igr1=2022, 2023, &end
# Atom 1: H ILE 134, Atom 2: HB ILE 134
 &rst iat=2030, 2034, r3=3.900000, r4=4.400000, &end
# Atom 1: H ILE 134, Atom 2: QG2 ILE 134
 &rst iat=2030, -1, r3=4.500000, r4=5.000000, igr2=2036, 2037, 2038, &end
# Atom 1: H ILE 134, Atom 2: HG12 ILE 134
 &rst iat=2030, 2040, r3=3.900000, r4=4.400000, &end
# Atom 1: H ILE 134, Atom 2: HG13 ILE 134
 &rst iat=2030, 2041, r3=3.900000, r4=4.400000, &end
# Atom 1: H ILE 134, Atom 2: QG1 ILE 134
 &rst iat=2030, -1, r3=3.700000, r4=4.200000, igr2=2040, 2041, &end
# Atom 1: H ILE 134, Atom 2: QD ILE 134
 &rst iat=2030, -1, r3=5.300000, r4=5.800000, igr2=2043, 2044, 2045, &end
# Atom 1: H ILE 134, Atom 2: H ILE 135
 &rst iat=2030, 2049, r3=3.600000, r4=4.100000, &end
# Atom 1: H ILE 134, Atom 2: H ILE 137
 &rst iat=2030, 2090, r3=5.300000, r4=5.800000, &end
# Atom 1: HA ILE 134, Atom 2: H LYS 136
 &rst iat=2032, 2068, r3=5.200000, r4=5.700000, &end
# Atom 1: HA ILE 134, Atom 2: H ILE 137
 &rst iat=2032, 2090, r3=4.400000, r4=4.900000, &end
# Atom 1: HA ILE 134, Atom 2: H ILE 138
 &rst iat=2032, 2109, r3=4.900000, r4=5.400000, &end
# Atom 1: QG2 ILE 134, Atom 2: H ILE 137
 &rst iat=-1, 2090, r3=7.000000, r4=7.500000, igr1=2036, 2037, 2038, &end
# Atom 1: QG2 ILE 134, Atom 2: H ILE 138
 &rst iat=-1, 2109, r3=6.200000, r4=6.700000, igr1=2036, 2037, 2038, &end
# Atom 1: QG1 ILE 134, Atom 2: H LYS 136
 &rst iat=-1, 2068, r3=6.780000, r4=7.280000, igr1=2040, 2041, &end
# Atom 1: QD ILE 134, Atom 2: H ILE 135
 &rst iat=-1, 2049, r3=7.000000, r4=7.500000, igr1=2043, 2044, 2045, &end
# Atom 1: H ILE 135, Atom 2: HB ILE 135
 &rst iat=2049, 2053, r3=3.800000, r4=4.300000, &end
# Atom 1: H ILE 135, Atom 2: QG2 ILE 135
 &rst iat=2049, -1, r3=4.700000, r4=5.200000, igr2=2055, 2056, 2057, &end
# Atom 1: H ILE 135, Atom 2: HG12 ILE 135
 &rst iat=2049, 2059, r3=4.800000, r4=5.300000, &end
# Atom 1: H ILE 135, Atom 2: HG13 ILE 135
 &rst iat=2049, 2060, r3=4.800000, r4=5.300000, &end
# Atom 1: H ILE 135, Atom 2: QG1 ILE 135
 &rst iat=2049, -1, r3=4.240000, r4=4.740000, igr2=2059, 2060, &end
# Atom 1: H ILE 135, Atom 2: QD ILE 135
 &rst iat=2049, -1, r3=4.500000, r4=5.000000, igr2=2062, 2063, 2064, &end
# Atom 1: H ILE 135, Atom 2: H LYS 136
 &rst iat=2049, 2068, r3=3.600000, r4=4.100000, &end
# Atom 1: H ILE 135, Atom 2: QB LYS 136
 &rst iat=2049, -1, r3=5.580000, r4=6.080000, igr2=2072, 2073, &end
# Atom 1: H ILE 135, Atom 2: H ILE 137
 &rst iat=2049, 2090, r3=4.900000, r4=5.400000, &end
# Atom 1: H ILE 135, Atom 2: H ILE 138
 &rst iat=2049, 2109, r3=4.800000, r4=5.300000, &end
# Atom 1: H ILE 135, Atom 2: H GLU 139
 &rst iat=2049, 2128, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ILE 135, Atom 2: H ILE 137
 &rst iat=2051, 2090, r3=4.900000, r4=5.400000, &end
# Atom 1: HA ILE 135, Atom 2: H ILE 138
 &rst iat=2051, 2109, r3=5.000000, r4=5.500000, &end
# Atom 1: HA ILE 135, Atom 2: H GLU 139
 &rst iat=2051, 2128, r3=5.600000, r4=6.100000, &end
# Atom 1: HB ILE 135, Atom 2: H LYS 136
 &rst iat=2053, 2068, r3=3.500000, r4=4.000000, &end
# Atom 1: HB ILE 135, Atom 2: H GLU 139
 &rst iat=2053, 2128, r3=5.800000, r4=6.300000, &end
# Atom 1: QG2 ILE 135, Atom 2: H LYS 136
 &rst iat=-1, 2068, r3=5.600000, r4=6.100000, igr1=2055, 2056, 2057, &end
# Atom 1: QG2 ILE 135, Atom 2: H GLU 139
 &rst iat=-1, 2128, r3=6.800000, r4=7.300000, igr1=2055, 2056, 2057, &end
# Atom 1: QG2 ILE 135, Atom 2: H ALA 145
 &rst iat=-1, 2221, r3=6.700000, r4=7.200000, igr1=2055, 2056, 2057, &end
# Atom 1: HG12 ILE 135, Atom 2: H ILE 138
 &rst iat=2059, 2109, r3=6.000000, r4=6.500000, &end
# Atom 1: HG12 ILE 135, Atom 2: H ALA 145
 &rst iat=2059, 2221, r3=6.000000, r4=6.500000, &end
# Atom 1: HG13 ILE 135, Atom 2: H ILE 138
 &rst iat=2060, 2109, r3=6.000000, r4=6.500000, &end
# Atom 1: HG13 ILE 135, Atom 2: H ALA 145
 &rst iat=2060, 2221, r3=6.000000, r4=6.500000, &end
# Atom 1: QG1 ILE 135, Atom 2: H LYS 136
 &rst iat=-1, 2068, r3=6.480000, r4=6.980000, igr1=2059, 2060, &end
# Atom 1: QG1 ILE 135, Atom 2: H ILE 137
 &rst iat=-1, 2090, r3=6.880000, r4=7.380000, igr1=2059, 2060, &end
# Atom 1: QG1 ILE 135, Atom 2: H GLU 139
 &rst iat=-1, 2128, r3=6.880000, r4=7.380000, igr1=2059, 2060, &end
# Atom 1: QD ILE 135, Atom 2: H LYS 136
 &rst iat=-1, 2068, r3=6.100000, r4=6.600000, igr1=2062, 2063, 2064, &end
# Atom 1: H LYS 136, Atom 2: HB2 LYS 136
 &rst iat=2068, 2072, r3=3.300000, r4=3.800000, &end
# Atom 1: H LYS 136, Atom 2: HB3 LYS 136
 &rst iat=2068, 2073, r3=3.300000, r4=3.800000, &end
# Atom 1: H LYS 136, Atom 2: HG2 LYS 136
 &rst iat=2068, 2075, r3=4.200000, r4=4.700000, &end
# Atom 1: H LYS 136, Atom 2: HG3 LYS 136
 &rst iat=2068, 2076, r3=4.200000, r4=4.700000, &end
# Atom 1: H LYS 136, Atom 2: QG LYS 136
 &rst iat=2068, -1, r3=3.960000, r4=4.460000, igr2=2075, 2076, &end
# Atom 1: H LYS 136, Atom 2: QD LYS 136
 &rst iat=2068, -1, r3=5.200000, r4=5.700000, igr2=2078, 2079, &end
# Atom 1: H LYS 136, Atom 2: QE LYS 136
 &rst iat=2068, -1, r3=6.800000, r4=7.300000, igr2=2081, 2082, &end
# Atom 1: H LYS 136, Atom 2: H ILE 137
 &rst iat=2068, 2090, r3=3.600000, r4=4.100000, &end
# Atom 1: H LYS 136, Atom 2: QD ILE 138
 &rst iat=2068, -1, r3=6.600000, r4=7.100000, igr2=2122, 2123, 2124, &end
# Atom 1: H LYS 136, Atom 2: H GLU 139
 &rst iat=2068, 2128, r3=5.200000, r4=5.700000, &end
# Atom 1: H LYS 136, Atom 2: HG2 GLU 139
 &rst iat=2068, 2135, r3=6.000000, r4=6.500000, &end
# Atom 1: H LYS 136, Atom 2: HG3 GLU 139
 &rst iat=2068, 2136, r3=6.000000, r4=6.500000, &end
# Atom 1: HA LYS 136, Atom 2: H ILE 138
 &rst iat=2070, 2109, r3=6.000000, r4=6.500000, &end
# Atom 1: HA LYS 136, Atom 2: H GLU 139
 &rst iat=2070, 2128, r3=4.600000, r4=5.100000, &end
# Atom 1: HA LYS 136, Atom 2: H GLU 140
 &rst iat=2070, 2143, r3=5.800000, r4=6.300000, &end
# Atom 1: QB LYS 136, Atom 2: H ILE 138
 &rst iat=-1, 2109, r3=6.480000, r4=6.980000, igr1=2072, 2073, &end
# Atom 1: HG2 LYS 136, Atom 2: H ILE 137
 &rst iat=2075, 2090, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 LYS 136, Atom 2: H GLU 139
 &rst iat=2075, 2128, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 LYS 136, Atom 2: H ILE 137
 &rst iat=2076, 2090, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 LYS 136, Atom 2: H GLU 139
 &rst iat=2076, 2128, r3=6.000000, r4=6.500000, &end
# Atom 1: QD LYS 136, Atom 2: H GLU 140
 &rst iat=-1, 2143, r3=7.000000, r4=7.500000, igr1=2078, 2079, &end
# Atom 1: QE LYS 136, Atom 2: H ILE 137
 &rst iat=-1, 2090, r3=7.000000, r4=7.500000, igr1=2081, 2082, &end
# Atom 1: H ILE 137, Atom 2: HB ILE 137
 &rst iat=2090, 2094, r3=3.700000, r4=4.200000, &end
# Atom 1: H ILE 137, Atom 2: QG2 ILE 137
 &rst iat=2090, -1, r3=4.900000, r4=5.400000, igr2=2096, 2097, 2098, &end
# Atom 1: H ILE 137, Atom 2: HG12 ILE 137
 &rst iat=2090, 2100, r3=4.000000, r4=4.500000, &end
# Atom 1: H ILE 137, Atom 2: HG13 ILE 137
 &rst iat=2090, 2101, r3=4.000000, r4=4.500000, &end
# Atom 1: H ILE 137, Atom 2: QG1 ILE 137
 &rst iat=2090, -1, r3=3.750000, r4=4.250000, igr2=2100, 2101, &end
# Atom 1: H ILE 137, Atom 2: QD ILE 137
 &rst iat=2090, -1, r3=4.700000, r4=5.200000, igr2=2103, 2104, 2105, &end
# Atom 1: H ILE 137, Atom 2: H ILE 138
 &rst iat=2090, 2109, r3=3.600000, r4=4.100000, &end
# Atom 1: H ILE 137, Atom 2: HA ILE 138
 &rst iat=2090, 2111, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 137, Atom 2: QD ILE 138
 &rst iat=2090, -1, r3=6.800000, r4=7.300000, igr2=2122, 2123, 2124, &end
# Atom 1: H ILE 137, Atom 2: H GLU 139
 &rst iat=2090, 2128, r3=5.500000, r4=6.000000, &end
# Atom 1: H ILE 137, Atom 2: QB GLU 139
 &rst iat=2090, -1, r3=7.000000, r4=7.500000, igr2=2132, 2133, &end
# Atom 1: H ILE 137, Atom 2: H GLU 140
 &rst iat=2090, 2143, r3=6.000000, r4=6.500000, &end
# Atom 1: H ILE 137, Atom 2: QB GLU 140
 &rst iat=2090, -1, r3=6.880000, r4=7.380000, igr2=2147, 2148, &end
# Atom 1: HA ILE 137, Atom 2: H GLU 139
 &rst iat=2092, 2128, r3=5.900000, r4=6.400000, &end
# Atom 1: HA ILE 137, Atom 2: H GLU 140
 &rst iat=2092, 2143, r3=4.900000, r4=5.400000, &end
# Atom 1: HA ILE 137, Atom 2: H ILE 141
 &rst iat=2092, 2158, r3=5.900000, r4=6.400000, &end
# Atom 1: HB ILE 137, Atom 2: H GLU 140
 &rst iat=2094, 2143, r3=5.700000, r4=6.200000, &end
# Atom 1: QG2 ILE 137, Atom 2: H ILE 138
 &rst iat=-1, 2109, r3=5.100000, r4=5.600000, igr1=2096, 2097, 2098, &end
# Atom 1: QG2 ILE 137, Atom 2: H GLU 140
 &rst iat=-1, 2143, r3=6.900000, r4=7.400000, igr1=2096, 2097, 2098, &end
# Atom 1: QG2 ILE 137, Atom 2: H ILE 141
 &rst iat=-1, 2158, r3=7.000000, r4=7.500000, igr1=2096, 2097, 2098, &end
# Atom 1: QG1 ILE 137, Atom 2: H ILE 138
 &rst iat=-1, 2109, r3=6.880000, r4=7.380000, igr1=2100, 2101, &end
# Atom 1: QG1 ILE 137, Atom 2: H GLU 140
 &rst iat=-1, 2143, r3=6.880000, r4=7.380000, igr1=2100, 2101, &end
# Atom 1: H ILE 138, Atom 2: HB ILE 138
 &rst iat=2109, 2113, r3=3.800000, r4=4.300000, &end
# Atom 1: H ILE 138, Atom 2: QG2 ILE 138
 &rst iat=2109, -1, r3=4.600000, r4=5.100000, igr2=2115, 2116, 2117, &end
# Atom 1: H ILE 138, Atom 2: HG12 ILE 138
 &rst iat=2109, 2119, r3=4.100000, r4=4.600000, &end
# Atom 1: H ILE 138, Atom 2: HG13 ILE 138
 &rst iat=2109, 2120, r3=4.100000, r4=4.600000, &end
# Atom 1: H ILE 138, Atom 2: QG1 ILE 138
 &rst iat=2109, -1, r3=3.850000, r4=4.350000, igr2=2119, 2120, &end
# Atom 1: H ILE 138, Atom 2: QD ILE 138
 &rst iat=2109, -1, r3=4.500000, r4=5.000000, igr2=2122, 2123, 2124, &end
# Atom 1: H ILE 138, Atom 2: H GLU 139
 &rst iat=2109, 2128, r3=3.600000, r4=4.100000, &end
# Atom 1: H ILE 138, Atom 2: HA GLU 139
 &rst iat=2109, 2130, r3=5.800000, r4=6.300000, &end
# Atom 1: H ILE 138, Atom 2: QB GLU 139
 &rst iat=2109, -1, r3=6.100000, r4=6.600000, igr2=2132, 2133, &end
# Atom 1: H ILE 138, Atom 2: QG GLU 139
 &rst iat=2109, -1, r3=6.880000, r4=7.380000, igr2=2135, 2136, &end
# Atom 1: H ILE 138, Atom 2: H GLU 140
 &rst iat=2109, 2143, r3=4.300000, r4=4.800000, &end
# Atom 1: H ILE 138, Atom 2: QB GLU 140
 &rst iat=2109, -1, r3=6.180000, r4=6.680000, igr2=2147, 2148, &end
# Atom 1: H ILE 138, Atom 2: QB ALA 145
 &rst iat=2109, -1, r3=7.000000, r4=7.500000, igr2=2225, 2226, 2227, &end
# Atom 1: HA ILE 138, Atom 2: H GLU 140
 &rst iat=2111, 2143, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ILE 138, Atom 2: H ILE 141
 &rst iat=2111, 2158, r3=4.700000, r4=5.200000, &end
# Atom 1: HA ILE 138, Atom 2: H GLY 142
 &rst iat=2111, 2177, r3=5.000000, r4=5.500000, &end
# Atom 1: HA ILE 138, Atom 2: H PHE 143
 &rst iat=2111, 2184, r3=5.200000, r4=5.700000, &end
# Atom 1: HB ILE 138, Atom 2: H GLU 139
 &rst iat=2113, 2128, r3=4.000000, r4=4.500000, &end
# Atom 1: HB ILE 138, Atom 2: H GLU 140
 &rst iat=2113, 2143, r3=5.600000, r4=6.100000, &end
# Atom 1: HB ILE 138, Atom 2: H ILE 141
 &rst iat=2113, 2158, r3=4.700000, r4=5.200000, &end
# Atom 1: QG2 ILE 138, Atom 2: H GLU 139
 &rst iat=-1, 2128, r3=6.300000, r4=6.800000, igr1=2115, 2116, 2117, &end
# Atom 1: QG2 ILE 138, Atom 2: H GLU 140
 &rst iat=-1, 2143, r3=7.000000, r4=7.500000, igr1=2115, 2116, 2117, &end
# Atom 1: QG2 ILE 138, Atom 2: H ILE 141
 &rst iat=-1, 2158, r3=6.300000, r4=6.800000, igr1=2115, 2116, 2117, &end
# Atom 1: QG2 ILE 138, Atom 2: H GLY 142
 &rst iat=-1, 2177, r3=7.000000, r4=7.500000, igr1=2115, 2116, 2117, &end
# Atom 1: QG2 ILE 138, Atom 2: H PHE 143
 &rst iat=-1, 2184, r3=6.800000, r4=7.300000, igr1=2115, 2116, 2117, &end
# Atom 1: QG2 ILE 138, Atom 2: H HID 144
 &rst iat=-1, 2204, r3=7.000000, r4=7.500000, igr1=2115, 2116, 2117, &end
# Atom 1: QG2 ILE 138, Atom 2: H ALA 145
 &rst iat=-1, 2221, r3=7.000000, r4=7.500000, igr1=2115, 2116, 2117, &end
# Atom 1: HG12 ILE 138, Atom 2: H PHE 143
 &rst iat=2119, 2184, r3=5.700000, r4=6.200000, &end
# Atom 1: HG12 ILE 138, Atom 2: H ALA 145
 &rst iat=2119, 2221, r3=6.000000, r4=6.500000, &end
# Atom 1: HG13 ILE 138, Atom 2: H PHE 143
 &rst iat=2120, 2184, r3=5.700000, r4=6.200000, &end
# Atom 1: HG13 ILE 138, Atom 2: H ALA 145
 &rst iat=2120, 2221, r3=6.000000, r4=6.500000, &end
# Atom 1: QG1 ILE 138, Atom 2: H GLU 139
 &rst iat=-1, 2128, r3=6.780000, r4=7.280000, igr1=2119, 2120, &end
# Atom 1: QG1 ILE 138, Atom 2: H GLY 142
 &rst iat=-1, 2177, r3=6.880000, r4=7.380000, igr1=2119, 2120, &end
# Atom 1: QG1 ILE 138, Atom 2: H PHE 143
 &rst iat=-1, 2184, r3=5.480000, r4=5.980000, igr1=2119, 2120, &end
# Atom 1: QD ILE 138, Atom 2: H GLU 139
 &rst iat=-1, 2128, r3=7.000000, r4=7.500000, igr1=2122, 2123, 2124, &end
# Atom 1: QD ILE 138, Atom 2: H GLU 140
 &rst iat=-1, 2143, r3=7.000000, r4=7.500000, igr1=2122, 2123, 2124, &end
# Atom 1: QD ILE 138, Atom 2: H ILE 141
 &rst iat=-1, 2158, r3=7.000000, r4=7.500000, igr1=2122, 2123, 2124, &end
# Atom 1: QD ILE 138, Atom 2: H PHE 143
 &rst iat=-1, 2184, r3=7.000000, r4=7.500000, igr1=2122, 2123, 2124, &end
# Atom 1: QD ILE 138, Atom 2: H HID 144
 &rst iat=-1, 2204, r3=7.000000, r4=7.500000, igr1=2122, 2123, 2124, &end
# Atom 1: QD ILE 138, Atom 2: H ALA 145
 &rst iat=-1, 2221, r3=7.000000, r4=7.500000, igr1=2122, 2123, 2124, &end
# Atom 1: H GLU 139, Atom 2: HG2 GLU 139
 &rst iat=2128, 2135, r3=3.800000, r4=4.300000, &end
# Atom 1: H GLU 139, Atom 2: HG3 GLU 139
 &rst iat=2128, 2136, r3=3.800000, r4=4.300000, &end
# Atom 1: H GLU 139, Atom 2: QB GLU 140
 &rst iat=2128, -1, r3=6.280000, r4=6.780000, igr2=2147, 2148, &end
# Atom 1: H GLU 139, Atom 2: H ILE 141
 &rst iat=2128, 2158, r3=4.400000, r4=4.900000, &end
# Atom 1: H GLU 139, Atom 2: H GLY 142
 &rst iat=2128, 2177, r3=4.900000, r4=5.400000, &end
# Atom 1: H GLU 139, Atom 2: H PHE 143
 &rst iat=2128, 2184, r3=5.500000, r4=6.000000, &end
# Atom 1: H GLU 139, Atom 2: QB ALA 145
 &rst iat=2128, -1, r3=7.000000, r4=7.500000, igr2=2225, 2226, 2227, &end
# Atom 1: HA GLU 139, Atom 2: H GLU 140
 &rst iat=2130, 2143, r3=3.600000, r4=4.100000, &end
# Atom 1: HA GLU 139, Atom 2: H ILE 141
 &rst iat=2130, 2158, r3=5.700000, r4=6.200000, &end
# Atom 1: HA GLU 139, Atom 2: H GLY 142
 &rst iat=2130, 2177, r3=5.000000, r4=5.500000, &end
# Atom 1: HA GLU 139, Atom 2: H PHE 143
 &rst iat=2130, 2184, r3=4.200000, r4=4.700000, &end
# Atom 1: QB GLU 139, Atom 2: H GLY 142
 &rst iat=-1, 2177, r3=6.300000, r4=6.800000, igr1=2132, 2133, &end
# Atom 1: HG2 GLU 139, Atom 2: H ALA 145
 &rst iat=2135, 2221, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLU 139, Atom 2: H ALA 145
 &rst iat=2136, 2221, r3=6.000000, r4=6.500000, &end
# Atom 1: QG GLU 139, Atom 2: H GLY 142
 &rst iat=-1, 2177, r3=6.780000, r4=7.280000, igr1=2135, 2136, &end
# Atom 1: H GLU 140, Atom 2: HB2 GLU 140
 &rst iat=2143, 2147, r3=3.300000, r4=3.800000, &end
# Atom 1: H GLU 140, Atom 2: HB3 GLU 140
 &rst iat=2143, 2148, r3=3.300000, r4=3.800000, &end
# Atom 1: H GLU 140, Atom 2: QB GLU 140
 &rst iat=2143, -1, r3=2.980000, r4=3.480000, igr2=2147, 2148, &end
# Atom 1: H GLU 140, Atom 2: QG GLU 140
 &rst iat=2143, -1, r3=4.480000, r4=4.980000, igr2=2150, 2151, &end
# Atom 1: H GLU 140, Atom 2: H ILE 141
 &rst iat=2143, 2158, r3=3.600000, r4=4.100000, &end
# Atom 1: H GLU 140, Atom 2: QG2 ILE 141
 &rst iat=2143, -1, r3=7.000000, r4=7.500000, igr2=2164, 2165, 2166, &end
# Atom 1: H GLU 140, Atom 2: QG1 ILE 141
 &rst iat=2143, -1, r3=6.880000, r4=7.380000, igr2=2168, 2169, &end
# Atom 1: H GLU 140, Atom 2: H GLY 142
 &rst iat=2143, 2177, r3=4.500000, r4=5.000000, &end
# Atom 1: H GLU 140, Atom 2: H PHE 143
 &rst iat=2143, 2184, r3=5.500000, r4=6.000000, &end
# Atom 1: HA GLU 140, Atom 2: H GLY 142
 &rst iat=2145, 2177, r3=5.500000, r4=6.000000, &end
# Atom 1: HB2 GLU 140, Atom 2: H GLY 142
 &rst iat=2147, 2177, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 GLU 140, Atom 2: H GLY 142
 &rst iat=2148, 2177, r3=6.000000, r4=6.500000, &end
# Atom 1: QB GLU 140, Atom 2: H GLY 142
 &rst iat=-1, 2177, r3=5.790000, r4=6.290000, igr1=2147, 2148, &end
# Atom 1: QG GLU 140, Atom 2: H ILE 141
 &rst iat=-1, 2158, r3=6.880000, r4=7.380000, igr1=2150, 2151, &end
# Atom 1: QG GLU 140, Atom 2: H GLY 142
 &rst iat=-1, 2177, r3=6.880000, r4=7.380000, igr1=2150, 2151, &end
# Atom 1: H ILE 141, Atom 2: HB ILE 141
 &rst iat=2158, 2162, r3=4.100000, r4=4.600000, &end
# Atom 1: H ILE 141, Atom 2: QG2 ILE 141
 &rst iat=2158, -1, r3=4.700000, r4=5.200000, igr2=2164, 2165, 2166, &end
# Atom 1: H ILE 141, Atom 2: HG12 ILE 141
 &rst iat=2158, 2168, r3=3.700000, r4=4.200000, &end
# Atom 1: H ILE 141, Atom 2: HG13 ILE 141
 &rst iat=2158, 2169, r3=3.700000, r4=4.200000, &end
# Atom 1: H ILE 141, Atom 2: QD ILE 141
 &rst iat=2158, -1, r3=5.000000, r4=5.500000, igr2=2171, 2172, 2173, &end
# Atom 1: H ILE 141, Atom 2: QA GLY 142
 &rst iat=2158, -1, r3=5.380000, r4=5.880000, igr2=2179, 2180, &end
# Atom 1: H ILE 141, Atom 2: H PHE 143
 &rst iat=2158, 2184, r3=5.000000, r4=5.500000, &end
# Atom 1: H ILE 141, Atom 2: QD PHE 143
 &rst iat=2158, -1, r3=8.000000, r4=8.500000, igr2=2192, 2200, &end
# Atom 1: HA ILE 141, Atom 2: H PHE 143
 &rst iat=2160, 2184, r3=5.500000, r4=6.000000, &end
# Atom 1: HB ILE 141, Atom 2: H GLY 142
 &rst iat=2162, 2177, r3=4.100000, r4=4.600000, &end
# Atom 1: HB ILE 141, Atom 2: H PHE 143
 &rst iat=2162, 2184, r3=3.800000, r4=4.300000, &end
# Atom 1: QG2 ILE 141, Atom 2: H GLY 142
 &rst iat=-1, 2177, r3=7.000000, r4=7.500000, igr1=2164, 2165, 2166, &end
# Atom 1: QG2 ILE 141, Atom 2: H PHE 143
 &rst iat=-1, 2184, r3=7.000000, r4=7.500000, igr1=2164, 2165, 2166, &end
# Atom 1: HG12 ILE 141, Atom 2: H GLY 142
 &rst iat=2168, 2177, r3=6.000000, r4=6.500000, &end
# Atom 1: HG12 ILE 141, Atom 2: H PHE 143
 &rst iat=2168, 2184, r3=5.800000, r4=6.300000, &end
# Atom 1: HG13 ILE 141, Atom 2: H GLY 142
 &rst iat=2169, 2177, r3=6.000000, r4=6.500000, &end
# Atom 1: HG13 ILE 141, Atom 2: H PHE 143
 &rst iat=2169, 2184, r3=5.800000, r4=6.300000, &end
# Atom 1: QG1 ILE 141, Atom 2: H PHE 143
 &rst iat=-1, 2184, r3=5.580000, r4=6.080000, igr1=2168, 2169, &end
# Atom 1: QD ILE 141, Atom 2: H GLY 142
 &rst iat=-1, 2177, r3=7.000000, r4=7.500000, igr1=2171, 2172, 2173, &end
# Atom 1: H GLY 142, Atom 2: H PHE 143
 &rst iat=2177, 2184, r3=3.200000, r4=3.700000, &end
# Atom 1: H GLY 142, Atom 2: HA PHE 143
 &rst iat=2177, 2186, r3=5.500000, r4=6.000000, &end
# Atom 1: H GLY 142, Atom 2: QB PHE 143
 &rst iat=2177, -1, r3=6.080000, r4=6.580000, igr2=2188, 2189, &end
# Atom 1: H GLY 142, Atom 2: QD PHE 143
 &rst iat=2177, -1, r3=8.000000, r4=8.500000, igr2=2192, 2200, &end
# Atom 1: H GLY 142, Atom 2: QE PHE 143
 &rst iat=2177, -1, r3=8.000000, r4=8.500000, igr2=2194, 2198, &end
# Atom 1: QA GLY 142, Atom 2: H HID 144
 &rst iat=-1, 2204, r3=6.880000, r4=7.380000, igr1=2179, 2180, &end
# Atom 1: H PHE 143, Atom 2: HB2 PHE 143
 &rst iat=2184, 2188, r3=4.000000, r4=4.500000, &end
# Atom 1: H PHE 143, Atom 2: HB3 PHE 143
 &rst iat=2184, 2189, r3=4.000000, r4=4.500000, &end
# Atom 1: H PHE 143, Atom 2: QB PHE 143
 &rst iat=2184, -1, r3=3.800000, r4=4.300000, igr2=2188, 2189, &end
# Atom 1: H PHE 143, Atom 2: H HID 144
 &rst iat=2184, 2204, r3=4.500000, r4=5.000000, &end
# Atom 1: H PHE 143, Atom 2: HA HID 144
 &rst iat=2184, 2206, r3=6.000000, r4=6.500000, &end
# Atom 1: HA PHE 143, Atom 2: H HID 144
 &rst iat=2186, 2204, r3=3.400000, r4=3.900000, &end
# Atom 1: HB2 PHE 143, Atom 2: H HID 144
 &rst iat=2188, 2204, r3=3.900000, r4=4.400000, &end
# Atom 1: HB3 PHE 143, Atom 2: H HID 144
 &rst iat=2189, 2204, r3=3.900000, r4=4.400000, &end
# Atom 1: QB PHE 143, Atom 2: H HID 144
 &rst iat=-1, 2204, r3=3.650000, r4=4.150000, igr1=2188, 2189, &end
# Atom 1: QD PHE 143, Atom 2: H HID 144
 &rst iat=-1, 2204, r3=8.000000, r4=8.500000, igr1=2192, 2200, &end
# Atom 1: H HID 144, Atom 2: HB2 HID 144
 &rst iat=2204, 2208, r3=4.000000, r4=4.500000, &end
# Atom 1: H HID 144, Atom 2: HB3 HID 144
 &rst iat=2204, 2209, r3=4.000000, r4=4.500000, &end
# Atom 1: H HID 144, Atom 2: QB HID 144
 &rst iat=2204, -1, r3=3.800000, r4=4.300000, igr2=2208, 2209, &end
# Atom 1: H HID 144, Atom 2: HD HID 144
 &rst iat=2204, 2217, r3=5.600000, r4=6.100000, &end
# Atom 1: H HID 144, Atom 2: H ALA 145
 &rst iat=2204, 2221, r3=4.700000, r4=5.200000, &end
# Atom 1: H HID 144, Atom 2: HA ALA 145
 &rst iat=2204, 2223, r3=6.000000, r4=6.500000, &end
# Atom 1: H HID 144, Atom 2: QB ALA 145
 &rst iat=2204, -1, r3=7.000000, r4=7.500000, igr2=2225, 2226, 2227, &end
# Atom 1: H HID 144, Atom 2: H SER 146
 &rst iat=2204, 2231, r3=6.000000, r4=6.500000, &end
# Atom 1: HA HID 144, Atom 2: H ALA 145
 &rst iat=2206, 2221, r3=3.200000, r4=3.700000, &end
# Atom 1: HB2 HID 144, Atom 2: H ALA 145
 &rst iat=2208, 2221, r3=4.500000, r4=5.000000, &end
# Atom 1: HB3 HID 144, Atom 2: H ALA 145
 &rst iat=2209, 2221, r3=4.500000, r4=5.000000, &end
# Atom 1: QB HID 144, Atom 2: H ALA 145
 &rst iat=-1, 2221, r3=4.310000, r4=4.810000, igr1=2208, 2209, &end
# Atom 1: QB HID 144, Atom 2: H SER 146
 &rst iat=-1, 2231, r3=6.880000, r4=7.380000, igr1=2208, 2209, &end
# Atom 1: H ALA 145, Atom 2: H SER 146
 &rst iat=2221, 2231, r3=4.600000, r4=5.100000, &end
# Atom 1: H ALA 145, Atom 2: HA SER 146
 &rst iat=2221, 2233, r3=6.000000, r4=6.500000, &end
# Atom 1: H ALA 145, Atom 2: QB SER 146
 &rst iat=2221, -1, r3=7.000000, r4=7.500000, igr2=2235, 2236, &end
# Atom 1: HA ALA 145, Atom 2: H SER 146
 &rst iat=2223, 2231, r3=3.100000, r4=3.600000, &end
# Atom 1: H SER 146, Atom 2: H LEU 147
 &rst iat=2231, 2242, r3=4.600000, r4=5.100000, &end
# Atom 1: H SER 146, Atom 2: HG LEU 147
 &rst iat=2231, 2249, r3=6.000000, r4=6.500000, &end
# Atom 1: H SER 146, Atom 2: QQD LEU 147
 &rst iat=2231, -1, r3=8.570000, r4=9.070000, igr2=2251, 2252, 2253, 2255, 2256, 2257, &end
# Atom 1: HA SER 146, Atom 2: H LEU 147
 &rst iat=2233, 2242, r3=3.200000, r4=3.700000, &end
# Atom 1: HA SER 146, Atom 2: H ALA 148
 &rst iat=2233, 2261, r3=5.800000, r4=6.300000, &end
# Atom 1: QB SER 146, Atom 2: H ALA 148
 &rst iat=-1, 2261, r3=7.000000, r4=7.500000, igr1=2235, 2236, &end
# Atom 1: H LEU 147, Atom 2: HB2 LEU 147
 &rst iat=2242, 2246, r3=3.900000, r4=4.400000, &end
# Atom 1: H LEU 147, Atom 2: HB3 LEU 147
 &rst iat=2242, 2247, r3=3.900000, r4=4.400000, &end
# Atom 1: H LEU 147, Atom 2: QD1 LEU 147
 &rst iat=2242, -1, r3=5.200000, r4=5.700000, igr2=2251, 2252, 2253, &end
# Atom 1: H LEU 147, Atom 2: QD2 LEU 147
 &rst iat=2242, -1, r3=5.200000, r4=5.700000, igr2=2255, 2256, 2257, &end
# Atom 1: H LEU 147, Atom 2: H ALA 148
 &rst iat=2242, 2261, r3=4.400000, r4=4.900000, &end
# Atom 1: H LEU 147, Atom 2: QB ALA 148
 &rst iat=2242, -1, r3=6.400000, r4=6.900000, igr2=2265, 2266, 2267, &end
# Atom 1: HG LEU 147, Atom 2: H ALA 148
 &rst iat=2249, 2261, r3=5.000000, r4=5.500000, &end
# Atom 1: HG LEU 147, Atom 2: H GLN 149
 &rst iat=2249, 2271, r3=5.500000, r4=6.000000, &end
# Atom 1: QD1 LEU 147, Atom 2: H ALA 148
 &rst iat=-1, 2261, r3=6.500000, r4=7.000000, igr1=2251, 2252, 2253, &end
# Atom 1: QD1 LEU 147, Atom 2: H GLN 149
 &rst iat=-1, 2271, r3=7.000000, r4=7.500000, igr1=2251, 2252, 2253, &end
# Atom 1: QD1 LEU 147, Atom 2: HNE1 GLN 149
 &rst iat=-1, 2283, r3=8.730000, r4=9.230000, igr1=2251, 2252, 2253, &end
# Atom 1: QD1 LEU 147, Atom 2: HNE2 GLN 149
 &rst iat=-1, 2284, r3=8.730000, r4=9.230000, igr1=2251, 2252, 2253, &end
# Atom 1: QD2 LEU 147, Atom 2: H ALA 148
 &rst iat=-1, 2261, r3=6.500000, r4=7.000000, igr1=2255, 2256, 2257, &end
# Atom 1: QD2 LEU 147, Atom 2: H GLN 149
 &rst iat=-1, 2271, r3=7.000000, r4=7.500000, igr1=2255, 2256, 2257, &end
# Atom 1: QD2 LEU 147, Atom 2: HNE1 GLN 149
 &rst iat=-1, 2283, r3=8.730000, r4=9.230000, igr1=2255, 2256, 2257, &end
# Atom 1: QD2 LEU 147, Atom 2: HNE2 GLN 149
 &rst iat=-1, 2284, r3=8.730000, r4=9.230000, igr1=2255, 2256, 2257, &end
# Atom 1: QQD LEU 147, Atom 2: H ALA 148
 &rst iat=-1, 2261, r3=6.150000, r4=6.650000, igr1=2251, 2252, 2253, 2255, 2256, 2257, &end
# Atom 1: QQD LEU 147, Atom 2: QNE GLN 149
 &rst iat=-1, -1, r3=7.710000, r4=8.210000, 
 igr1=2251, 2252, 2253, 2255, 2256, 2257, igr2=2283, 2284, &end
# Atom 1: H ALA 148, Atom 2: H GLN 149
 &rst iat=2261, 2271, r3=3.900000, r4=4.400000, &end
# Atom 1: H ALA 148, Atom 2: QB GLN 149
 &rst iat=2261, -1, r3=5.480000, r4=5.980000, igr2=2275, 2276, &end
# Atom 1: H GLN 149, Atom 2: HB2 GLN 149
 &rst iat=2271, 2275, r3=3.900000, r4=4.400000, &end
# Atom 1: H GLN 149, Atom 2: HB3 GLN 149
 &rst iat=2271, 2276, r3=3.900000, r4=4.400000, &end
# Atom 1: H GLN 149, Atom 2: QB GLN 149
 &rst iat=2271, -1, r3=3.500000, r4=4.000000, igr2=2275, 2276, &end
# Atom 1: H GLN 149, Atom 2: QG GLN 149
 &rst iat=2271, -1, r3=5.200000, r4=5.700000, igr2=2278, 2279, &end
# Atom 1: HA GLN 149, Atom 2: QNE GLN 149
 &rst iat=2273, -1, r3=6.870000, r4=7.370000, igr2=2283, 2284, &end
# Atom 1: HB2 GLN 149, Atom 2: HNE1 GLN 149
 &rst iat=2275, 2283, r3=5.700000, r4=6.200000, &end
# Atom 1: HB2 GLN 149, Atom 2: HNE2 GLN 149
 &rst iat=2275, 2284, r3=5.700000, r4=6.200000, &end
# Atom 1: HB3 GLN 149, Atom 2: HNE1 GLN 149
 &rst iat=2276, 2283, r3=5.700000, r4=6.200000, &end
# Atom 1: HB3 GLN 149, Atom 2: HNE2 GLN 149
 &rst iat=2276, 2284, r3=5.700000, r4=6.200000, &end


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