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
4738 1fmy cing 1-original 1 AMBER distance NOE simple


# Atom 1: HA GLN 1, Atom 2: HB2 GLN 1
 &rst iat=6, 8, r3=6.000000, r4=6.500000, r1=1.500000, r2=2.000000,
 rk2=32.000000, rk3=32.000000, ir6=1, &end
# Atom 1: HA GLN 1, Atom 2: HB3 GLN 1
 &rst iat=6, 9, r3=4.400000, r4=4.900000, &end
# Atom 1: HA GLN 1, Atom 2: HG2 GLN 1
 &rst iat=6, 11, r3=3.900000, r4=4.400000, &end
# Atom 1: HA GLN 1, Atom 2: HG3 GLN 1
 &rst iat=6, 12, r3=3.800000, r4=4.300000, &end
# Atom 1: HA GLN 1, Atom 2: HN ASN 2
 &rst iat=6, 21, r3=4.600000, r4=5.100000, &end
# Atom 1: HB2 GLN 1, Atom 2: HG2 GLN 1
 &rst iat=8, 11, r3=3.200000, r4=3.700000, &end
# Atom 1: HB2 GLN 1, Atom 2: HG3 GLN 1
 &rst iat=8, 12, r3=2.800000, r4=3.300000, &end
# Atom 1: HB3 GLN 1, Atom 2: HG2 GLN 1
 &rst iat=9, 11, r3=2.800000, r4=3.300000, &end
# Atom 1: HB3 GLN 1, Atom 2: HG3 GLN 1
 &rst iat=9, 12, r3=4.900000, r4=5.400000, &end
# Atom 1: HB3 GLN 1, Atom 2: HN ASN 2
 &rst iat=9, 21, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 GLN 1, Atom 2: HN ASN 2
 &rst iat=11, 21, r3=4.600000, r4=5.100000, &end
# Atom 1: HG2 GLN 1, Atom 2: HND2 ASN 2
 &rst iat=11, 31, r3=5.700000, r4=6.200000, &end
# Atom 1: HG3 GLN 1, Atom 2: HN ASN 2
 &rst iat=12, 21, r3=5.200000, r4=5.700000, &end
# Atom 1: HN ASN 2, Atom 2: HA ASN 2
 &rst iat=21, 23, r3=4.300000, r4=4.800000, &end
# Atom 1: HN ASN 2, Atom 2: HB2 ASN 2
 &rst iat=21, 25, r3=5.200000, r4=5.700000, &end
# Atom 1: HN ASN 2, Atom 2: HB3 ASN 2
 &rst iat=21, 26, r3=5.500000, r4=6.000000, &end
# Atom 1: HN ASN 2, Atom 2: HND1 ASN 2
 &rst iat=21, 30, r3=5.500000, r4=6.000000, &end
# Atom 1: HN ASN 2, Atom 2: HN GLU 3
 &rst iat=21, 35, r3=3.100000, r4=3.600000, &end
# Atom 1: HA ASN 2, Atom 2: HB2 ASN 2
 &rst iat=23, 25, r3=4.600000, r4=5.100000, &end
# Atom 1: HA ASN 2, Atom 2: HB3 ASN 2
 &rst iat=23, 26, r3=5.400000, r4=5.900000, &end
# Atom 1: HA ASN 2, Atom 2: HND1 ASN 2
 &rst iat=23, 30, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ASN 2, Atom 2: HN GLU 3
 &rst iat=23, 35, r3=4.200000, r4=4.700000, &end
# Atom 1: HB2 ASN 2, Atom 2: HND1 ASN 2
 &rst iat=25, 30, r3=3.700000, r4=4.200000, &end
# Atom 1: HB2 ASN 2, Atom 2: HND2 ASN 2
 &rst iat=25, 31, r3=5.000000, r4=5.500000, &end
# Atom 1: HB2 ASN 2, Atom 2: HN GLU 3
 &rst iat=25, 35, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 ASN 2, Atom 2: HND1 ASN 2
 &rst iat=26, 30, r3=4.100000, r4=4.600000, &end
# Atom 1: HB3 ASN 2, Atom 2: HND2 ASN 2
 &rst iat=26, 31, r3=5.200000, r4=5.700000, &end
# Atom 1: HB3 ASN 2, Atom 2: HN GLU 3
 &rst iat=26, 35, r3=4.900000, r4=5.400000, &end
# Atom 1: HND2 ASN 2, Atom 2: HG3 LYS 22
 &rst iat=31, 308, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLU 3, Atom 2: HA GLU 3
 &rst iat=35, 37, r3=3.800000, r4=4.300000, &end
# Atom 1: HN GLU 3, Atom 2: HB2 GLU 3
 &rst iat=35, 39, r3=3.900000, r4=4.400000, &end
# Atom 1: HN GLU 3, Atom 2: HB3 GLU 3
 &rst iat=35, 40, r3=4.000000, r4=4.500000, &end
# Atom 1: HN GLU 3, Atom 2: QG GLU 3
 &rst iat=35, -1, r3=5.000000, r4=5.500000, igr2=42, 43, &end
# Atom 1: HN GLU 3, Atom 2: HN GLY 4
 &rst iat=35, 50, r3=4.500000, r4=5.000000, &end
# Atom 1: HN GLU 3, Atom 2: HA2 GLY 4
 &rst iat=35, 52, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLU 3, Atom 2: QB SER 23
 &rst iat=35, -1, r3=7.000000, r4=7.500000, igr2=326, 327, &end
# Atom 1: HA GLU 3, Atom 2: HB2 GLU 3
 &rst iat=37, 39, r3=4.200000, r4=4.700000, &end
# Atom 1: HA GLU 3, Atom 2: HB3 GLU 3
 &rst iat=37, 40, r3=3.800000, r4=4.300000, &end
# Atom 1: HA GLU 3, Atom 2: QG GLU 3
 &rst iat=37, -1, r3=4.000000, r4=4.500000, igr2=42, 43, &end
# Atom 1: HA GLU 3, Atom 2: HN GLY 4
 &rst iat=37, 50, r3=4.500000, r4=5.000000, &end
# Atom 1: HA GLU 3, Atom 2: HA2 GLY 4
 &rst iat=37, 52, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLU 3, Atom 2: HA3 GLY 4
 &rst iat=37, 53, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 GLU 3, Atom 2: QG GLU 3
 &rst iat=39, -1, r3=4.400000, r4=4.900000, igr2=42, 43, &end
# Atom 1: HB2 GLU 3, Atom 2: HN GLY 4
 &rst iat=39, 50, r3=5.200000, r4=5.700000, &end
# Atom 1: HB3 GLU 3, Atom 2: QG GLU 3
 &rst iat=40, -1, r3=4.500000, r4=5.000000, igr2=42, 43, &end
# Atom 1: HB3 GLU 3, Atom 2: HN GLY 4
 &rst iat=40, 50, r3=4.300000, r4=4.800000, &end
# Atom 1: HB3 GLU 3, Atom 2: HA2 GLY 4
 &rst iat=40, 52, r3=6.000000, r4=6.500000, &end
# Atom 1: QG GLU 3, Atom 2: HN GLY 4
 &rst iat=-1, 50, r3=6.300000, r4=6.800000, igr1=42, 43, &end
# Atom 1: HN GLY 4, Atom 2: HA2 GLY 4
 &rst iat=50, 52, r3=3.800000, r4=4.300000, &end
# Atom 1: HN GLY 4, Atom 2: HA3 GLY 4
 &rst iat=50, 53, r3=3.500000, r4=4.000000, &end
# Atom 1: HN GLY 4, Atom 2: HN HID 5
 &rst iat=50, 57, r3=4.400000, r4=4.900000, &end
# Atom 1: HN GLY 4, Atom 2: HA HID 5
 &rst iat=50, 59, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLY 4, Atom 2: QB HID 5
 &rst iat=50, -1, r3=7.000000, r4=7.500000, igr2=61, 62, &end
# Atom 1: HN GLY 4, Atom 2: HA SER 23
 &rst iat=50, 324, r3=3.600000, r4=4.100000, &end
# Atom 1: HN GLY 4, Atom 2: QB SER 23
 &rst iat=50, -1, r3=7.000000, r4=7.500000, igr2=326, 327, &end
# Atom 1: HA2 GLY 4, Atom 2: HN HID 5
 &rst iat=52, 57, r3=3.600000, r4=4.100000, &end
# Atom 1: HA2 GLY 4, Atom 2: QB HID 5
 &rst iat=52, -1, r3=7.000000, r4=7.500000, igr2=61, 62, &end
# Atom 1: HA2 GLY 4, Atom 2: HND HID 5
 &rst iat=52, 65, r3=5.800000, r4=6.300000, &end
# Atom 1: HA2 GLY 4, Atom 2: HA SER 23
 &rst iat=52, 324, r3=4.100000, r4=4.600000, &end
# Atom 1: HA2 GLY 4, Atom 2: HN CYS 24
 &rst iat=52, 333, r3=5.900000, r4=6.400000, &end
# Atom 1: HA2 GLY 4, Atom 2: HA SER 25
 &rst iat=52, 347, r3=6.000000, r4=6.500000, &end
# Atom 1: HA3 GLY 4, Atom 2: HN HID 5
 &rst iat=53, 57, r3=3.400000, r4=3.900000, &end
# Atom 1: HA3 GLY 4, Atom 2: HND HID 5
 &rst iat=53, 65, r3=4.700000, r4=5.200000, &end
# Atom 1: HA3 GLY 4, Atom 2: HE HID 5
 &rst iat=53, 67, r3=6.000000, r4=6.500000, &end
# Atom 1: HA3 GLY 4, Atom 2: HA SER 23
 &rst iat=53, 324, r3=3.100000, r4=3.600000, &end
# Atom 1: HA3 GLY 4, Atom 2: HN CYS 24
 &rst iat=53, 333, r3=4.800000, r4=5.300000, &end
# Atom 1: HA3 GLY 4, Atom 2: HA CYS 24
 &rst iat=53, 335, r3=6.000000, r4=6.500000, &end
# Atom 1: HN HID 5, Atom 2: HA HID 5
 &rst iat=57, 59, r3=3.700000, r4=4.200000, &end
# Atom 1: HN HID 5, Atom 2: QB HID 5
 &rst iat=57, -1, r3=5.300000, r4=5.800000, igr2=61, 62, &end
# Atom 1: HN HID 5, Atom 2: HND HID 5
 &rst iat=57, 65, r3=3.900000, r4=4.400000, &end
# Atom 1: HN HID 5, Atom 2: HE HID 5
 &rst iat=57, 67, r3=4.800000, r4=5.300000, &end
# Atom 1: HN HID 5, Atom 2: HN GLU 6
 &rst iat=57, 74, r3=4.500000, r4=5.000000, &end
# Atom 1: HN HID 5, Atom 2: QB GLU 6
 &rst iat=57, -1, r3=7.000000, r4=7.500000, igr2=78, 79, &end
# Atom 1: HN HID 5, Atom 2: HN CYS 7
 &rst iat=57, 89, r3=4.800000, r4=5.300000, &end
# Atom 1: HN HID 5, Atom 2: HN SER 23
 &rst iat=57, 322, r3=6.000000, r4=6.500000, &end
# Atom 1: HN HID 5, Atom 2: HN CYS 24
 &rst iat=57, 333, r3=3.400000, r4=3.900000, &end
# Atom 1: HN HID 5, Atom 2: HB3 CYS 24
 &rst iat=57, 338, r3=5.100000, r4=5.600000, &end
# Atom 1: HA HID 5, Atom 2: QB HID 5
 &rst iat=59, -1, r3=4.700000, r4=5.200000, igr2=61, 62, &end
# Atom 1: HA HID 5, Atom 2: HND HID 5
 &rst iat=59, 65, r3=4.700000, r4=5.200000, &end
# Atom 1: HA HID 5, Atom 2: HN GLU 6
 &rst iat=59, 74, r3=3.800000, r4=4.300000, &end
# Atom 1: QB HID 5, Atom 2: HND HID 5
 &rst iat=-1, 65, r3=4.400000, r4=4.900000, igr1=61, 62, &end
# Atom 1: QB HID 5, Atom 2: HE HID 5
 &rst iat=-1, 67, r3=6.200000, r4=6.700000, igr1=61, 62, &end
# Atom 1: QB HID 5, Atom 2: HN GLU 6
 &rst iat=-1, 74, r3=4.700000, r4=5.200000, igr1=61, 62, &end
# Atom 1: QB HID 5, Atom 2: QB GLU 6
 &rst iat=-1, -1, r3=7.500000, r4=8.000000, 
 igr1=61, 62, igr2=78, 79, &end
# Atom 1: QB HID 5, Atom 2: HN CYS 7
 &rst iat=-1, 89, r3=7.000000, r4=7.500000, igr1=61, 62, &end
# Atom 1: QB HID 5, Atom 2: HN CYS 24
 &rst iat=-1, 333, r3=6.800000, r4=7.300000, igr1=61, 62, &end
# Atom 1: QB HID 5, Atom 2: HB3 CYS 24
 &rst iat=-1, 338, r3=6.700000, r4=7.200000, igr1=61, 62, &end
# Atom 1: HND HID 5, Atom 2: HE HID 5
 &rst iat=65, 67, r3=5.000000, r4=5.500000, &end
# Atom 1: HND HID 5, Atom 2: HN GLU 6
 &rst iat=65, 74, r3=5.600000, r4=6.100000, &end
# Atom 1: HND HID 5, Atom 2: HA GLU 6
 &rst iat=65, 76, r3=5.400000, r4=5.900000, &end
# Atom 1: HND HID 5, Atom 2: QB GLU 6
 &rst iat=65, -1, r3=7.000000, r4=7.500000, igr2=78, 79, &end
# Atom 1: HND HID 5, Atom 2: HA CYS 7
 &rst iat=65, 91, r3=4.800000, r4=5.300000, &end
# Atom 1: HND HID 5, Atom 2: HN GLN 8
 &rst iat=65, 101, r3=5.900000, r4=6.400000, &end
# Atom 1: HND HID 5, Atom 2: HB3 CYS 24
 &rst iat=65, 338, r3=6.000000, r4=6.500000, &end
# Atom 1: HND HID 5, Atom 2: HA SER 25
 &rst iat=65, 347, r3=5.100000, r4=5.600000, &end
# Atom 1: HND HID 5, Atom 2: HN CYS 26
 &rst iat=65, 356, r3=6.000000, r4=6.500000, &end
# Atom 1: HND HID 5, Atom 2: HB2 CYS 26
 &rst iat=65, 360, r3=6.000000, r4=6.500000, &end
# Atom 1: HE HID 5, Atom 2: HN GLU 6
 &rst iat=67, 74, r3=5.400000, r4=5.900000, &end
# Atom 1: HE HID 5, Atom 2: HN CYS 7
 &rst iat=67, 89, r3=6.000000, r4=6.500000, &end
# Atom 1: HE HID 5, Atom 2: HA CYS 7
 &rst iat=67, 91, r3=4.800000, r4=5.300000, &end
# Atom 1: HE HID 5, Atom 2: HB2 CYS 7
 &rst iat=67, 93, r3=4.600000, r4=5.100000, &end
# Atom 1: HE HID 5, Atom 2: HN GLN 8
 &rst iat=67, 101, r3=5.700000, r4=6.200000, &end
# Atom 1: HE HID 5, Atom 2: HA CYS 24
 &rst iat=67, 335, r3=6.000000, r4=6.500000, &end
# Atom 1: HE HID 5, Atom 2: HB2 CYS 24
 &rst iat=67, 337, r3=5.600000, r4=6.100000, &end
# Atom 1: HE HID 5, Atom 2: HB3 CYS 24
 &rst iat=67, 338, r3=4.400000, r4=4.900000, &end
# Atom 1: HE HID 5, Atom 2: HN SER 25
 &rst iat=67, 345, r3=4.800000, r4=5.300000, &end
# Atom 1: HE HID 5, Atom 2: HA SER 25
 &rst iat=67, 347, r3=5.500000, r4=6.000000, &end
# Atom 1: HE HID 5, Atom 2: HN CYS 26
 &rst iat=67, 356, r3=4.600000, r4=5.100000, &end
# Atom 1: HE HID 5, Atom 2: HA CYS 26
 &rst iat=67, 358, r3=6.000000, r4=6.500000, &end
# Atom 1: HE HID 5, Atom 2: HB2 CYS 26
 &rst iat=67, 360, r3=4.300000, r4=4.800000, &end
# Atom 1: HE HID 5, Atom 2: HB3 CYS 26
 &rst iat=67, 361, r3=6.000000, r4=6.500000, &end
# Atom 1: HE HID 5, Atom 2: HA PRO 27
 &rst iat=67, 378, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLU 6, Atom 2: HA GLU 6
 &rst iat=74, 76, r3=3.600000, r4=4.100000, &end
# Atom 1: HN GLU 6, Atom 2: QB GLU 6
 &rst iat=74, -1, r3=4.200000, r4=4.700000, igr2=78, 79, &end
# Atom 1: HN GLU 6, Atom 2: HG2 GLU 6
 &rst iat=74, 81, r3=3.500000, r4=4.000000, &end
# Atom 1: HN GLU 6, Atom 2: HG3 GLU 6
 &rst iat=74, 82, r3=3.800000, r4=4.300000, &end
# Atom 1: HN GLU 6, Atom 2: HN CYS 7
 &rst iat=74, 89, r3=4.200000, r4=4.700000, &end
# Atom 1: HN GLU 6, Atom 2: HA LYS 22
 &rst iat=74, 302, r3=5.300000, r4=5.800000, &end
# Atom 1: HA GLU 6, Atom 2: QB GLU 6
 &rst iat=76, -1, r3=4.800000, r4=5.300000, igr2=78, 79, &end
# Atom 1: HA GLU 6, Atom 2: HG2 GLU 6
 &rst iat=76, 81, r3=3.500000, r4=4.000000, &end
# Atom 1: HA GLU 6, Atom 2: HG3 GLU 6
 &rst iat=76, 82, r3=3.800000, r4=4.300000, &end
# Atom 1: HA GLU 6, Atom 2: HN CYS 7
 &rst iat=76, 89, r3=3.300000, r4=3.800000, &end
# Atom 1: HA GLU 6, Atom 2: HB2 CYS 7
 &rst iat=76, 93, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLU 6, Atom 2: HN GLN 8
 &rst iat=76, 101, r3=5.100000, r4=5.600000, &end
# Atom 1: HA GLU 6, Atom 2: HNE1 GLN 8
 &rst iat=76, 113, r3=5.000000, r4=5.500000, &end
# Atom 1: HA GLU 6, Atom 2: HA LYS 22
 &rst iat=76, 302, r3=3.600000, r4=4.100000, &end
# Atom 1: QB GLU 6, Atom 2: HG2 GLU 6
 &rst iat=-1, 81, r3=4.000000, r4=4.500000, igr1=78, 79, &end
# Atom 1: QB GLU 6, Atom 2: HG3 GLU 6
 &rst iat=-1, 82, r3=3.900000, r4=4.400000, igr1=78, 79, &end
# Atom 1: QB GLU 6, Atom 2: HN CYS 7
 &rst iat=-1, 89, r3=5.100000, r4=5.600000, igr1=78, 79, &end
# Atom 1: QB GLU 6, Atom 2: HNE1 GLN 8
 &rst iat=-1, 113, r3=5.300000, r4=5.800000, igr1=78, 79, &end
# Atom 1: QB GLU 6, Atom 2: HNE2 GLN 8
 &rst iat=-1, 114, r3=6.100000, r4=6.600000, igr1=78, 79, &end
# Atom 1: HG2 GLU 6, Atom 2: HN CYS 7
 &rst iat=81, 89, r3=4.400000, r4=4.900000, &end
# Atom 1: HG2 GLU 6, Atom 2: HNE1 GLN 8
 &rst iat=81, 113, r3=4.900000, r4=5.400000, &end
# Atom 1: HG2 GLU 6, Atom 2: HNE2 GLN 8
 &rst iat=81, 114, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 GLU 6, Atom 2: HA LYS 22
 &rst iat=81, 302, r3=5.300000, r4=5.800000, &end
# Atom 1: HG3 GLU 6, Atom 2: HN CYS 7
 &rst iat=82, 89, r3=5.500000, r4=6.000000, &end
# Atom 1: HG3 GLU 6, Atom 2: HNE1 GLN 8
 &rst iat=82, 113, r3=5.500000, r4=6.000000, &end
# Atom 1: HG3 GLU 6, Atom 2: HNE2 GLN 8
 &rst iat=82, 114, r3=5.800000, r4=6.300000, &end
# Atom 1: HG3 GLU 6, Atom 2: HA LYS 22
 &rst iat=82, 302, r3=5.800000, r4=6.300000, &end
# Atom 1: HN CYS 7, Atom 2: HA CYS 7
 &rst iat=89, 91, r3=3.600000, r4=4.100000, &end
# Atom 1: HN CYS 7, Atom 2: HB2 CYS 7
 &rst iat=89, 93, r3=3.800000, r4=4.300000, &end
# Atom 1: HN CYS 7, Atom 2: HB3 CYS 7
 &rst iat=89, 94, r3=3.500000, r4=4.000000, &end
# Atom 1: HN CYS 7, Atom 2: HN GLN 8
 &rst iat=89, 101, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 7, Atom 2: HA GLN 8
 &rst iat=89, 103, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 7, Atom 2: HN CYS 9
 &rst iat=89, 118, r3=5.300000, r4=5.800000, &end
# Atom 1: HN CYS 7, Atom 2: HA GLN 21
 &rst iat=89, 285, r3=3.700000, r4=4.200000, &end
# Atom 1: HN CYS 7, Atom 2: HB2 GLN 21
 &rst iat=89, 287, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 7, Atom 2: HB3 GLN 21
 &rst iat=89, 288, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 7, Atom 2: HNE1 GLN 21
 &rst iat=89, 295, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 7, Atom 2: HN LYS 22
 &rst iat=89, 300, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 7, Atom 2: HA LYS 22
 &rst iat=89, 302, r3=4.700000, r4=5.200000, &end
# Atom 1: HN CYS 7, Atom 2: HG2 LYS 22
 &rst iat=89, 307, r3=5.800000, r4=6.300000, &end
# Atom 1: HN CYS 7, Atom 2: HN SER 23
 &rst iat=89, 322, r3=5.300000, r4=5.800000, &end
# Atom 1: HN CYS 7, Atom 2: HN CYS 24
 &rst iat=89, 333, r3=4.500000, r4=5.000000, &end
# Atom 1: HN CYS 7, Atom 2: HB2 CYS 24
 &rst iat=89, 337, r3=4.600000, r4=5.100000, &end
# Atom 1: HN CYS 7, Atom 2: HB3 CYS 24
 &rst iat=89, 338, r3=4.800000, r4=5.300000, &end
# Atom 1: HA CYS 7, Atom 2: HB2 CYS 7
 &rst iat=91, 93, r3=4.000000, r4=4.500000, &end
# Atom 1: HA CYS 7, Atom 2: HB3 CYS 7
 &rst iat=91, 94, r3=4.300000, r4=4.800000, &end
# Atom 1: HA CYS 7, Atom 2: HN GLN 8
 &rst iat=91, 101, r3=3.500000, r4=4.000000, &end
# Atom 1: HA CYS 7, Atom 2: HA GLN 8
 &rst iat=91, 103, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 7, Atom 2: HB2 GLN 8
 &rst iat=91, 105, r3=5.900000, r4=6.400000, &end
# Atom 1: HA CYS 7, Atom 2: HN CYS 9
 &rst iat=91, 118, r3=3.600000, r4=4.100000, &end
# Atom 1: HA CYS 7, Atom 2: HA CYS 9
 &rst iat=91, 120, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 7, Atom 2: HA GLN 21
 &rst iat=91, 285, r3=5.000000, r4=5.500000, &end
# Atom 1: HA CYS 7, Atom 2: HB2 CYS 24
 &rst iat=91, 337, r3=4.700000, r4=5.200000, &end
# Atom 1: HA CYS 7, Atom 2: HB3 CYS 24
 &rst iat=91, 338, r3=4.000000, r4=4.500000, &end
# Atom 1: HA CYS 7, Atom 2: HB2 CYS 26
 &rst iat=91, 360, r3=4.600000, r4=5.100000, &end
# Atom 1: HB2 CYS 7, Atom 2: HN GLN 8
 &rst iat=93, 101, r3=5.500000, r4=6.000000, &end
# Atom 1: HB2 CYS 7, Atom 2: HN CYS 9
 &rst iat=93, 118, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 7, Atom 2: HN GLN 21
 &rst iat=93, 283, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 7, Atom 2: HA GLN 21
 &rst iat=93, 285, r3=3.400000, r4=3.900000, &end
# Atom 1: HB2 CYS 7, Atom 2: HNE1 GLN 21
 &rst iat=93, 295, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 7, Atom 2: HNE2 GLN 21
 &rst iat=93, 296, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 7, Atom 2: HA LYS 22
 &rst iat=93, 302, r3=4.600000, r4=5.100000, &end
# Atom 1: HB2 CYS 7, Atom 2: HN CYS 24
 &rst iat=93, 333, r3=4.200000, r4=4.700000, &end
# Atom 1: HB2 CYS 7, Atom 2: HB2 CYS 24
 &rst iat=93, 337, r3=3.600000, r4=4.100000, &end
# Atom 1: HB2 CYS 7, Atom 2: HB3 CYS 24
 &rst iat=93, 338, r3=3.400000, r4=3.900000, &end
# Atom 1: HB3 CYS 7, Atom 2: HN GLN 8
 &rst iat=94, 101, r3=5.900000, r4=6.400000, &end
# Atom 1: HB3 CYS 7, Atom 2: HA GLN 8
 &rst iat=94, 103, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 7, Atom 2: HN CYS 9
 &rst iat=94, 118, r3=5.900000, r4=6.400000, &end
# Atom 1: HB3 CYS 7, Atom 2: HN GLN 21
 &rst iat=94, 283, r3=5.600000, r4=6.100000, &end
# Atom 1: HB3 CYS 7, Atom 2: HA GLN 21
 &rst iat=94, 285, r3=2.700000, r4=3.200000, &end
# Atom 1: HB3 CYS 7, Atom 2: HB2 GLN 21
 &rst iat=94, 287, r3=5.000000, r4=5.500000, &end
# Atom 1: HB3 CYS 7, Atom 2: HB3 GLN 21
 &rst iat=94, 288, r3=5.200000, r4=5.700000, &end
# Atom 1: HB3 CYS 7, Atom 2: HG2 GLN 21
 &rst iat=94, 290, r3=5.200000, r4=5.700000, &end
# Atom 1: HB3 CYS 7, Atom 2: HG3 GLN 21
 &rst iat=94, 291, r3=5.700000, r4=6.200000, &end
# Atom 1: HB3 CYS 7, Atom 2: HNE1 GLN 21
 &rst iat=94, 295, r3=5.900000, r4=6.400000, &end
# Atom 1: HB3 CYS 7, Atom 2: HNE2 GLN 21
 &rst iat=94, 296, r3=5.400000, r4=5.900000, &end
# Atom 1: HB3 CYS 7, Atom 2: HN CYS 24
 &rst iat=94, 333, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 7, Atom 2: HB2 CYS 24
 &rst iat=94, 337, r3=3.800000, r4=4.300000, &end
# Atom 1: HB3 CYS 7, Atom 2: HB3 CYS 24
 &rst iat=94, 338, r3=4.300000, r4=4.800000, &end
# Atom 1: HN GLN 8, Atom 2: HA GLN 8
 &rst iat=101, 103, r3=3.800000, r4=4.300000, &end
# Atom 1: HN GLN 8, Atom 2: HB2 GLN 8
 &rst iat=101, 105, r3=3.700000, r4=4.200000, &end
# Atom 1: HN GLN 8, Atom 2: HB3 GLN 8
 &rst iat=101, 106, r3=4.500000, r4=5.000000, &end
# Atom 1: HN GLN 8, Atom 2: QG GLN 8
 &rst iat=101, -1, r3=4.500000, r4=5.000000, igr2=108, 109, &end
# Atom 1: HN GLN 8, Atom 2: HNE1 GLN 8
 &rst iat=101, 113, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLN 8, Atom 2: HNE2 GLN 8
 &rst iat=101, 114, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLN 8, Atom 2: HN CYS 9
 &rst iat=101, 118, r3=3.500000, r4=4.000000, &end
# Atom 1: HN GLN 8, Atom 2: HA CYS 9
 &rst iat=101, 120, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLN 8, Atom 2: HB2 CYS 9
 &rst iat=101, 122, r3=5.300000, r4=5.800000, &end
# Atom 1: HN GLN 8, Atom 2: HA GLN 21
 &rst iat=101, 285, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLN 8, Atom 2: HA LYS 22
 &rst iat=101, 302, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLN 8, Atom 2: HB2 GLN 8
 &rst iat=103, 105, r3=4.300000, r4=4.800000, &end
# Atom 1: HA GLN 8, Atom 2: HB3 GLN 8
 &rst iat=103, 106, r3=4.100000, r4=4.600000, &end
# Atom 1: HA GLN 8, Atom 2: QG GLN 8
 &rst iat=103, -1, r3=4.200000, r4=4.700000, igr2=108, 109, &end
# Atom 1: HA GLN 8, Atom 2: HNE1 GLN 8
 &rst iat=103, 113, r3=5.200000, r4=5.700000, &end
# Atom 1: HA GLN 8, Atom 2: HNE2 GLN 8
 &rst iat=103, 114, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLN 8, Atom 2: HN CYS 9
 &rst iat=103, 118, r3=3.900000, r4=4.400000, &end
# Atom 1: HA GLN 8, Atom 2: HA CYS 9
 &rst iat=103, 120, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLN 8, Atom 2: HB3 GLN 21
 &rst iat=103, 288, r3=5.600000, r4=6.100000, &end
# Atom 1: HB2 GLN 8, Atom 2: QG GLN 8
 &rst iat=105, -1, r3=3.600000, r4=4.100000, igr2=108, 109, &end
# Atom 1: HB2 GLN 8, Atom 2: HNE1 GLN 8
 &rst iat=105, 113, r3=5.600000, r4=6.100000, &end
# Atom 1: HB2 GLN 8, Atom 2: HNE2 GLN 8
 &rst iat=105, 114, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 GLN 8, Atom 2: HN CYS 9
 &rst iat=105, 118, r3=5.000000, r4=5.500000, &end
# Atom 1: HB3 GLN 8, Atom 2: QG GLN 8
 &rst iat=106, -1, r3=3.600000, r4=4.100000, igr2=108, 109, &end
# Atom 1: HB3 GLN 8, Atom 2: HNE1 GLN 8
 &rst iat=106, 113, r3=5.300000, r4=5.800000, &end
# Atom 1: HB3 GLN 8, Atom 2: HNE2 GLN 8
 &rst iat=106, 114, r3=5.800000, r4=6.300000, &end
# Atom 1: HB3 GLN 8, Atom 2: HN CYS 9
 &rst iat=106, 118, r3=5.900000, r4=6.400000, &end
# Atom 1: QG GLN 8, Atom 2: HNE1 GLN 8
 &rst iat=-1, 113, r3=4.500000, r4=5.000000, igr1=108, 109, &end
# Atom 1: QG GLN 8, Atom 2: HNE2 GLN 8
 &rst iat=-1, 114, r3=5.400000, r4=5.900000, igr1=108, 109, &end
# Atom 1: QG GLN 8, Atom 2: HN CYS 9
 &rst iat=-1, 118, r3=6.100000, r4=6.600000, igr1=108, 109, &end
# Atom 1: HNE1 GLN 8, Atom 2: HNE1 GLN 21
 &rst iat=113, 295, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE1 GLN 8, Atom 2: HNE2 GLN 21
 &rst iat=113, 296, r3=6.000000, r4=6.500000, &end
# Atom 1: HNE2 GLN 8, Atom 2: HNE2 GLN 21
 &rst iat=114, 296, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 9, Atom 2: HA CYS 9
 &rst iat=118, 120, r3=4.100000, r4=4.600000, &end
# Atom 1: HN CYS 9, Atom 2: HB2 CYS 9
 &rst iat=118, 122, r3=3.600000, r4=4.100000, &end
# Atom 1: HN CYS 9, Atom 2: HB3 CYS 9
 &rst iat=118, 123, r3=4.300000, r4=4.800000, &end
# Atom 1: HN CYS 9, Atom 2: HN GLN 10
 &rst iat=118, 130, r3=5.000000, r4=5.500000, &end
# Atom 1: HN CYS 9, Atom 2: HA GLN 10
 &rst iat=118, 132, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 9, Atom 2: HN CYS 11
 &rst iat=118, 147, r3=5.300000, r4=5.800000, &end
# Atom 1: HN CYS 9, Atom 2: HB2 CYS 11
 &rst iat=118, 151, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 9, Atom 2: HB2 CYS 14
 &rst iat=118, 181, r3=5.100000, r4=5.600000, &end
# Atom 1: HN CYS 9, Atom 2: HB3 CYS 14
 &rst iat=118, 182, r3=4.600000, r4=5.100000, &end
# Atom 1: HN CYS 9, Atom 2: HA GLN 21
 &rst iat=118, 285, r3=5.500000, r4=6.000000, &end
# Atom 1: HN CYS 9, Atom 2: HNE1 GLN 21
 &rst iat=118, 295, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 9, Atom 2: HB2 CYS 24
 &rst iat=118, 337, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 9, Atom 2: HB2 CYS 9
 &rst iat=120, 122, r3=4.400000, r4=4.900000, &end
# Atom 1: HA CYS 9, Atom 2: HB3 CYS 9
 &rst iat=120, 123, r3=3.900000, r4=4.400000, &end
# Atom 1: HA CYS 9, Atom 2: HN GLN 10
 &rst iat=120, 130, r3=3.300000, r4=3.800000, &end
# Atom 1: HA CYS 9, Atom 2: HA GLN 10
 &rst iat=120, 132, r3=5.900000, r4=6.400000, &end
# Atom 1: HA CYS 9, Atom 2: HB2 GLN 10
 &rst iat=120, 134, r3=5.700000, r4=6.200000, &end
# Atom 1: HA CYS 9, Atom 2: HB3 GLN 10
 &rst iat=120, 135, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 9, Atom 2: HG2 GLN 10
 &rst iat=120, 137, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 9, Atom 2: HG3 GLN 10
 &rst iat=120, 138, r3=5.500000, r4=6.000000, &end
# Atom 1: HA CYS 9, Atom 2: HN CYS 11
 &rst iat=120, 147, r3=4.000000, r4=4.500000, &end
# Atom 1: HA CYS 9, Atom 2: HB2 CYS 14
 &rst iat=120, 181, r3=5.100000, r4=5.600000, &end
# Atom 1: HA CYS 9, Atom 2: HB3 CYS 14
 &rst iat=120, 182, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 9, Atom 2: HN CYS 30
 &rst iat=120, 403, r3=4.700000, r4=5.200000, &end
# Atom 1: HA CYS 9, Atom 2: HB2 CYS 30
 &rst iat=120, 407, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 9, Atom 2: HN GLN 10
 &rst iat=122, 130, r3=4.600000, r4=5.100000, &end
# Atom 1: HB2 CYS 9, Atom 2: HA GLN 10
 &rst iat=122, 132, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 9, Atom 2: HN CYS 11
 &rst iat=122, 147, r3=4.100000, r4=4.600000, &end
# Atom 1: HB2 CYS 9, Atom 2: HN CYS 14
 &rst iat=122, 177, r3=5.400000, r4=5.900000, &end
# Atom 1: HB2 CYS 9, Atom 2: HA CYS 14
 &rst iat=122, 179, r3=5.100000, r4=5.600000, &end
# Atom 1: HB2 CYS 9, Atom 2: HB2 CYS 14
 &rst iat=122, 181, r3=2.800000, r4=3.300000, &end
# Atom 1: HB2 CYS 9, Atom 2: HB3 CYS 14
 &rst iat=122, 182, r3=2.800000, r4=3.300000, &end
# Atom 1: HB2 CYS 9, Atom 2: HN LYS 15
 &rst iat=122, 189, r3=5.200000, r4=5.700000, &end
# Atom 1: HB2 CYS 9, Atom 2: HNE1 GLN 21
 &rst iat=122, 295, r3=4.900000, r4=5.400000, &end
# Atom 1: HB3 CYS 9, Atom 2: HN GLN 10
 &rst iat=123, 130, r3=4.100000, r4=4.600000, &end
# Atom 1: HB3 CYS 9, Atom 2: HA GLN 10
 &rst iat=123, 132, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 9, Atom 2: HN CYS 11
 &rst iat=123, 147, r3=3.300000, r4=3.800000, &end
# Atom 1: HB3 CYS 9, Atom 2: HB2 CYS 11
 &rst iat=123, 151, r3=4.900000, r4=5.400000, &end
# Atom 1: HB3 CYS 9, Atom 2: HB3 CYS 11
 &rst iat=123, 152, r3=5.700000, r4=6.200000, &end
# Atom 1: HB3 CYS 9, Atom 2: HN CYS 14
 &rst iat=123, 177, r3=4.700000, r4=5.200000, &end
# Atom 1: HB3 CYS 9, Atom 2: HA CYS 14
 &rst iat=123, 179, r3=5.400000, r4=5.900000, &end
# Atom 1: HB3 CYS 9, Atom 2: HB2 CYS 14
 &rst iat=123, 181, r3=3.400000, r4=3.900000, &end
# Atom 1: HB3 CYS 9, Atom 2: HB3 CYS 14
 &rst iat=123, 182, r3=3.700000, r4=4.200000, &end
# Atom 1: HB3 CYS 9, Atom 2: HN LYS 15
 &rst iat=123, 189, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLN 10, Atom 2: HA GLN 10
 &rst iat=130, 132, r3=4.000000, r4=4.500000, &end
# Atom 1: HN GLN 10, Atom 2: HB2 GLN 10
 &rst iat=130, 134, r3=3.600000, r4=4.100000, &end
# Atom 1: HN GLN 10, Atom 2: HB3 GLN 10
 &rst iat=130, 135, r3=4.500000, r4=5.000000, &end
# Atom 1: HN GLN 10, Atom 2: HG2 GLN 10
 &rst iat=130, 137, r3=3.400000, r4=3.900000, &end
# Atom 1: HN GLN 10, Atom 2: HG3 GLN 10
 &rst iat=130, 138, r3=3.700000, r4=4.200000, &end
# Atom 1: HN GLN 10, Atom 2: HNE1 GLN 10
 &rst iat=130, 142, r3=4.700000, r4=5.200000, &end
# Atom 1: HN GLN 10, Atom 2: HNE2 GLN 10
 &rst iat=130, 143, r3=5.900000, r4=6.400000, &end
# Atom 1: HN GLN 10, Atom 2: HN CYS 11
 &rst iat=130, 147, r3=3.500000, r4=4.000000, &end
# Atom 1: HN GLN 10, Atom 2: HA CYS 11
 &rst iat=130, 149, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLN 10, Atom 2: HB2 CYS 11
 &rst iat=130, 151, r3=5.300000, r4=5.800000, &end
# Atom 1: HN GLN 10, Atom 2: HB2 CYS 14
 &rst iat=130, 181, r3=5.400000, r4=5.900000, &end
# Atom 1: HN GLN 10, Atom 2: HB3 CYS 14
 &rst iat=130, 182, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLN 10, Atom 2: QE LYS 15
 &rst iat=130, -1, r3=5.800000, r4=6.300000, igr2=202, 203, &end
# Atom 1: HN GLN 10, Atom 2: HN ASN 31
 &rst iat=130, 415, r3=5.000000, r4=5.500000, &end
# Atom 1: HN GLN 10, Atom 2: HA ASN 31
 &rst iat=130, 417, r3=4.200000, r4=4.700000, &end
# Atom 1: HN GLN 10, Atom 2: HB2 ASN 31
 &rst iat=130, 419, r3=4.500000, r4=5.000000, &end
# Atom 1: HN GLN 10, Atom 2: HB3 ASN 31
 &rst iat=130, 420, r3=5.200000, r4=5.700000, &end
# Atom 1: HN GLN 10, Atom 2: HND2 ASN 31
 &rst iat=130, 425, r3=5.100000, r4=5.600000, &end
# Atom 1: HA GLN 10, Atom 2: HB2 GLN 10
 &rst iat=132, 134, r3=3.700000, r4=4.200000, &end
# Atom 1: HA GLN 10, Atom 2: HB3 GLN 10
 &rst iat=132, 135, r3=3.400000, r4=3.900000, &end
# Atom 1: HA GLN 10, Atom 2: HG2 GLN 10
 &rst iat=132, 137, r3=3.000000, r4=3.500000, &end
# Atom 1: HA GLN 10, Atom 2: HG3 GLN 10
 &rst iat=132, 138, r3=3.500000, r4=4.000000, &end
# Atom 1: HA GLN 10, Atom 2: HNE1 GLN 10
 &rst iat=132, 142, r3=4.700000, r4=5.200000, &end
# Atom 1: HA GLN 10, Atom 2: HNE2 GLN 10
 &rst iat=132, 143, r3=5.800000, r4=6.300000, &end
# Atom 1: HA GLN 10, Atom 2: HN CYS 11
 &rst iat=132, 147, r3=4.200000, r4=4.700000, &end
# Atom 1: HA GLN 10, Atom 2: HN LYS 15
 &rst iat=132, 189, r3=5.700000, r4=6.200000, &end
# Atom 1: HA GLN 10, Atom 2: HA LYS 15
 &rst iat=132, 191, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLN 10, Atom 2: HB2 LYS 15
 &rst iat=132, 193, r3=4.200000, r4=4.700000, &end
# Atom 1: HA GLN 10, Atom 2: HB3 LYS 15
 &rst iat=132, 194, r3=5.000000, r4=5.500000, &end
# Atom 1: HA GLN 10, Atom 2: QG LYS 15
 &rst iat=132, -1, r3=6.000000, r4=6.500000, igr2=196, 197, &end
# Atom 1: HA GLN 10, Atom 2: QE LYS 15
 &rst iat=132, -1, r3=5.800000, r4=6.300000, igr2=202, 203, &end
# Atom 1: HB2 GLN 10, Atom 2: HG2 GLN 10
 &rst iat=134, 137, r3=2.900000, r4=3.400000, &end
# Atom 1: HB2 GLN 10, Atom 2: HG3 GLN 10
 &rst iat=134, 138, r3=2.700000, r4=3.200000, &end
# Atom 1: HB2 GLN 10, Atom 2: HNE1 GLN 10
 &rst iat=134, 142, r3=4.900000, r4=5.400000, &end
# Atom 1: HB2 GLN 10, Atom 2: HNE2 GLN 10
 &rst iat=134, 143, r3=5.000000, r4=5.500000, &end
# Atom 1: HB2 GLN 10, Atom 2: HN CYS 11
 &rst iat=134, 147, r3=4.900000, r4=5.400000, &end
# Atom 1: HB2 GLN 10, Atom 2: HN ASN 31
 &rst iat=134, 415, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 GLN 10, Atom 2: HA ASN 31
 &rst iat=134, 417, r3=3.200000, r4=3.700000, &end
# Atom 1: HB2 GLN 10, Atom 2: HB2 ASN 31
 &rst iat=134, 419, r3=3.700000, r4=4.200000, &end
# Atom 1: HB2 GLN 10, Atom 2: HND1 ASN 31
 &rst iat=134, 424, r3=4.900000, r4=5.400000, &end
# Atom 1: HB2 GLN 10, Atom 2: HND2 ASN 31
 &rst iat=134, 425, r3=4.800000, r4=5.300000, &end
# Atom 1: HB3 GLN 10, Atom 2: HG2 GLN 10
 &rst iat=135, 137, r3=2.800000, r4=3.300000, &end
# Atom 1: HB3 GLN 10, Atom 2: HG3 GLN 10
 &rst iat=135, 138, r3=3.100000, r4=3.600000, &end
# Atom 1: HB3 GLN 10, Atom 2: HNE1 GLN 10
 &rst iat=135, 142, r3=5.000000, r4=5.500000, &end
# Atom 1: HB3 GLN 10, Atom 2: HNE2 GLN 10
 &rst iat=135, 143, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 GLN 10, Atom 2: HN CYS 11
 &rst iat=135, 147, r3=5.500000, r4=6.000000, &end
# Atom 1: HB3 GLN 10, Atom 2: QE LYS 15
 &rst iat=135, -1, r3=5.800000, r4=6.300000, igr2=202, 203, &end
# Atom 1: HG2 GLN 10, Atom 2: HNE1 GLN 10
 &rst iat=137, 142, r3=3.100000, r4=3.600000, &end
# Atom 1: HG2 GLN 10, Atom 2: HNE2 GLN 10
 &rst iat=137, 143, r3=4.000000, r4=4.500000, &end
# Atom 1: HG2 GLN 10, Atom 2: HN CYS 11
 &rst iat=137, 147, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 GLN 10, Atom 2: QE LYS 15
 &rst iat=137, -1, r3=5.900000, r4=6.400000, igr2=202, 203, &end
# Atom 1: HG2 GLN 10, Atom 2: HND2 ASN 31
 &rst iat=137, 425, r3=5.700000, r4=6.200000, &end
# Atom 1: HG3 GLN 10, Atom 2: HNE1 GLN 10
 &rst iat=138, 142, r3=3.600000, r4=4.100000, &end
# Atom 1: HG3 GLN 10, Atom 2: HNE2 GLN 10
 &rst iat=138, 143, r3=4.300000, r4=4.800000, &end
# Atom 1: HG3 GLN 10, Atom 2: HN CYS 11
 &rst iat=138, 147, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 GLN 10, Atom 2: HND2 ASN 31
 &rst iat=138, 425, r3=5.600000, r4=6.100000, &end
# Atom 1: HNE2 GLN 10, Atom 2: QE LYS 15
 &rst iat=143, -1, r3=7.000000, r4=7.500000, igr2=202, 203, &end
# Atom 1: HN CYS 11, Atom 2: HA CYS 11
 &rst iat=147, 149, r3=4.700000, r4=5.200000, &end
# Atom 1: HN CYS 11, Atom 2: HB2 CYS 11
 &rst iat=147, 151, r3=4.000000, r4=4.500000, &end
# Atom 1: HN CYS 11, Atom 2: HB3 CYS 11
 &rst iat=147, 152, r3=5.400000, r4=5.900000, &end
# Atom 1: HN CYS 11, Atom 2: HN GLY 12
 &rst iat=147, 159, r3=5.400000, r4=5.900000, &end
# Atom 1: HN CYS 11, Atom 2: HA2 GLY 12
 &rst iat=147, 161, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 11, Atom 2: HN SER 13
 &rst iat=147, 166, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 11, Atom 2: HN CYS 14
 &rst iat=147, 177, r3=5.200000, r4=5.700000, &end
# Atom 1: HN CYS 11, Atom 2: HA CYS 14
 &rst iat=147, 179, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 11, Atom 2: HB2 CYS 14
 &rst iat=147, 181, r3=4.600000, r4=5.100000, &end
# Atom 1: HN CYS 11, Atom 2: HB3 CYS 14
 &rst iat=147, 182, r3=5.500000, r4=6.000000, &end
# Atom 1: HN CYS 11, Atom 2: HN LYS 15
 &rst iat=147, 189, r3=5.700000, r4=6.200000, &end
# Atom 1: HN CYS 11, Atom 2: HA LYS 15
 &rst iat=147, 191, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 11, Atom 2: HB2 LYS 15
 &rst iat=147, 193, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 11, Atom 2: QG LYS 15
 &rst iat=147, -1, r3=6.700000, r4=7.200000, igr2=196, 197, &end
# Atom 1: HN CYS 11, Atom 2: QE LYS 15
 &rst iat=147, -1, r3=7.000000, r4=7.500000, igr2=202, 203, &end
# Atom 1: HN CYS 11, Atom 2: HA SER 32
 &rst iat=147, 431, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 11, Atom 2: HB2 CYS 11
 &rst iat=149, 151, r3=3.600000, r4=4.100000, &end
# Atom 1: HA CYS 11, Atom 2: HB3 CYS 11
 &rst iat=149, 152, r3=4.400000, r4=4.900000, &end
# Atom 1: HA CYS 11, Atom 2: HN GLY 12
 &rst iat=149, 159, r3=3.600000, r4=4.100000, &end
# Atom 1: HA CYS 11, Atom 2: HN SER 13
 &rst iat=149, 166, r3=5.300000, r4=5.800000, &end
# Atom 1: HA CYS 11, Atom 2: HB2 CYS 14
 &rst iat=149, 181, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 11, Atom 2: HN LYS 15
 &rst iat=149, 189, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 11, Atom 2: HB2 LYS 15
 &rst iat=149, 193, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 11, Atom 2: HA SER 32
 &rst iat=149, 431, r3=5.100000, r4=5.600000, &end
# Atom 1: HB2 CYS 11, Atom 2: HN GLY 12
 &rst iat=151, 159, r3=4.600000, r4=5.100000, &end
# Atom 1: HB2 CYS 11, Atom 2: HN SER 13
 &rst iat=151, 166, r3=4.800000, r4=5.300000, &end
# Atom 1: HB2 CYS 11, Atom 2: QB SER 13
 &rst iat=151, -1, r3=6.500000, r4=7.000000, igr2=170, 171, &end
# Atom 1: HB2 CYS 11, Atom 2: HN CYS 14
 &rst iat=151, 177, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 11, Atom 2: HB3 CYS 14
 &rst iat=151, 182, r3=4.100000, r4=4.600000, &end
# Atom 1: HB2 CYS 11, Atom 2: HN LYS 15
 &rst iat=151, 189, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 11, Atom 2: HN SER 32
 &rst iat=151, 429, r3=3.800000, r4=4.300000, &end
# Atom 1: HB2 CYS 11, Atom 2: HA SER 32
 &rst iat=151, 431, r3=5.800000, r4=6.300000, &end
# Atom 1: HB2 CYS 11, Atom 2: HN ASP 33
 &rst iat=151, 440, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 11, Atom 2: HA ASP 33
 &rst iat=151, 442, r3=5.600000, r4=6.100000, &end
# Atom 1: HB2 CYS 11, Atom 2: HB2 CYS 36
 &rst iat=151, 490, r3=4.600000, r4=5.100000, &end
# Atom 1: HB3 CYS 11, Atom 2: HN GLY 12
 &rst iat=152, 159, r3=4.100000, r4=4.600000, &end
# Atom 1: HB3 CYS 11, Atom 2: HN SER 13
 &rst iat=152, 166, r3=3.800000, r4=4.300000, &end
# Atom 1: HB3 CYS 11, Atom 2: HN CYS 14
 &rst iat=152, 177, r3=5.000000, r4=5.500000, &end
# Atom 1: HB3 CYS 11, Atom 2: HA CYS 14
 &rst iat=152, 179, r3=4.700000, r4=5.200000, &end
# Atom 1: HB3 CYS 11, Atom 2: HB2 CYS 14
 &rst iat=152, 181, r3=3.800000, r4=4.300000, &end
# Atom 1: HB3 CYS 11, Atom 2: HN LYS 15
 &rst iat=152, 189, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 11, Atom 2: HA ASP 33
 &rst iat=152, 442, r3=4.300000, r4=4.800000, &end
# Atom 1: HB3 CYS 11, Atom 2: HB3 ASP 33
 &rst iat=152, 445, r3=5.500000, r4=6.000000, &end
# Atom 1: HB3 CYS 11, Atom 2: HB2 CYS 36
 &rst iat=152, 490, r3=5.700000, r4=6.200000, &end
# Atom 1: HN GLY 12, Atom 2: HA2 GLY 12
 &rst iat=159, 161, r3=3.700000, r4=4.200000, &end
# Atom 1: HN GLY 12, Atom 2: HA3 GLY 12
 &rst iat=159, 162, r3=3.300000, r4=3.800000, &end
# Atom 1: HN GLY 12, Atom 2: HN SER 13
 &rst iat=159, 166, r3=4.000000, r4=4.500000, &end
# Atom 1: HN GLY 12, Atom 2: QB SER 13
 &rst iat=159, -1, r3=7.000000, r4=7.500000, igr2=170, 171, &end
# Atom 1: HN GLY 12, Atom 2: HN CYS 14
 &rst iat=159, 177, r3=5.800000, r4=6.300000, &end
# Atom 1: HN GLY 12, Atom 2: HN LYS 15
 &rst iat=159, 189, r3=5.400000, r4=5.900000, &end
# Atom 1: HN GLY 12, Atom 2: HB2 LYS 15
 &rst iat=159, 193, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLY 12, Atom 2: HB3 LYS 15
 &rst iat=159, 194, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLY 12, Atom 2: QG LYS 15
 &rst iat=159, -1, r3=7.000000, r4=7.500000, igr2=196, 197, &end
# Atom 1: HN GLY 12, Atom 2: HB3 ASP 33
 &rst iat=159, 445, r3=6.000000, r4=6.500000, &end
# Atom 1: HA2 GLY 12, Atom 2: HN SER 13
 &rst iat=161, 166, r3=4.800000, r4=5.300000, &end
# Atom 1: HA2 GLY 12, Atom 2: HN CYS 14
 &rst iat=161, 177, r3=4.500000, r4=5.000000, &end
# Atom 1: HA2 GLY 12, Atom 2: HN LYS 15
 &rst iat=161, 189, r3=4.600000, r4=5.100000, &end
# Atom 1: HA2 GLY 12, Atom 2: HB2 LYS 15
 &rst iat=161, 193, r3=4.600000, r4=5.100000, &end
# Atom 1: HA2 GLY 12, Atom 2: HB3 LYS 15
 &rst iat=161, 194, r3=6.000000, r4=6.500000, &end
# Atom 1: HA2 GLY 12, Atom 2: QG LYS 15
 &rst iat=161, -1, r3=6.100000, r4=6.600000, igr2=196, 197, &end
# Atom 1: HA2 GLY 12, Atom 2: QE LYS 15
 &rst iat=161, -1, r3=7.000000, r4=7.500000, igr2=202, 203, &end
# Atom 1: HA3 GLY 12, Atom 2: HN SER 13
 &rst iat=162, 166, r3=4.400000, r4=4.900000, &end
# Atom 1: HA3 GLY 12, Atom 2: HN LYS 15
 &rst iat=162, 189, r3=6.000000, r4=6.500000, &end
# Atom 1: HN SER 13, Atom 2: HA SER 13
 &rst iat=166, 168, r3=4.200000, r4=4.700000, &end
# Atom 1: HN SER 13, Atom 2: QB SER 13
 &rst iat=166, -1, r3=4.800000, r4=5.300000, igr2=170, 171, &end
# Atom 1: HN SER 13, Atom 2: HN CYS 14
 &rst iat=166, 177, r3=4.000000, r4=4.500000, &end
# Atom 1: HN SER 13, Atom 2: HB2 CYS 14
 &rst iat=166, 181, r3=5.800000, r4=6.300000, &end
# Atom 1: HN SER 13, Atom 2: HB3 CYS 14
 &rst iat=166, 182, r3=6.000000, r4=6.500000, &end
# Atom 1: HN SER 13, Atom 2: HN LYS 15
 &rst iat=166, 189, r3=5.200000, r4=5.700000, &end
# Atom 1: HN SER 13, Atom 2: HB2 LYS 15
 &rst iat=166, 193, r3=6.000000, r4=6.500000, &end
# Atom 1: HN SER 13, Atom 2: HA ASP 33
 &rst iat=166, 442, r3=5.700000, r4=6.200000, &end
# Atom 1: HN SER 13, Atom 2: HB2 ASP 33
 &rst iat=166, 444, r3=6.000000, r4=6.500000, &end
# Atom 1: HN SER 13, Atom 2: HB3 ASP 33
 &rst iat=166, 445, r3=5.900000, r4=6.400000, &end
# Atom 1: HA SER 13, Atom 2: QB SER 13
 &rst iat=168, -1, r3=4.500000, r4=5.000000, igr2=170, 171, &end
# Atom 1: HA SER 13, Atom 2: HN CYS 14
 &rst iat=168, 177, r3=4.800000, r4=5.300000, &end
# Atom 1: HA SER 13, Atom 2: HND1 ASN 16
 &rst iat=168, 220, r3=4.700000, r4=5.200000, &end
# Atom 1: QB SER 13, Atom 2: HN CYS 14
 &rst iat=-1, 177, r3=6.100000, r4=6.600000, igr1=170, 171, &end
# Atom 1: QB SER 13, Atom 2: HB3 ASP 33
 &rst iat=-1, 445, r3=7.000000, r4=7.500000, igr1=170, 171, &end
# Atom 1: QB SER 13, Atom 2: HB3 CYS 38
 &rst iat=-1, 517, r3=6.800000, r4=7.300000, igr1=170, 171, &end
# Atom 1: QB SER 13, Atom 2: HN ASN 40
 &rst iat=-1, 531, r3=7.000000, r4=7.500000, igr1=170, 171, &end
# Atom 1: HN CYS 14, Atom 2: HA CYS 14
 &rst iat=177, 179, r3=3.900000, r4=4.400000, &end
# Atom 1: HN CYS 14, Atom 2: HB2 CYS 14
 &rst iat=177, 181, r3=3.600000, r4=4.100000, &end
# Atom 1: HN CYS 14, Atom 2: HB3 CYS 14
 &rst iat=177, 182, r3=4.400000, r4=4.900000, &end
# Atom 1: HN CYS 14, Atom 2: HN LYS 15
 &rst iat=177, 189, r3=3.400000, r4=3.900000, &end
# Atom 1: HN CYS 14, Atom 2: HA LYS 15
 &rst iat=177, 191, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 14, Atom 2: HB2 LYS 15
 &rst iat=177, 193, r3=5.200000, r4=5.700000, &end
# Atom 1: HN CYS 14, Atom 2: HB3 LYS 15
 &rst iat=177, 194, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 14, Atom 2: QG LYS 15
 &rst iat=177, -1, r3=7.000000, r4=7.500000, igr2=196, 197, &end
# Atom 1: HN CYS 14, Atom 2: HN ASN 17
 &rst iat=177, 225, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 14, Atom 2: HB2 CYS 14
 &rst iat=179, 181, r3=4.800000, r4=5.300000, &end
# Atom 1: HA CYS 14, Atom 2: HB3 CYS 14
 &rst iat=179, 182, r3=3.900000, r4=4.400000, &end
# Atom 1: HA CYS 14, Atom 2: HN LYS 15
 &rst iat=179, 189, r3=4.900000, r4=5.400000, &end
# Atom 1: HA CYS 14, Atom 2: HA LYS 15
 &rst iat=179, 191, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 14, Atom 2: HN ASN 17
 &rst iat=179, 225, r3=5.300000, r4=5.800000, &end
# Atom 1: HA CYS 14, Atom 2: HND1 ASN 17
 &rst iat=179, 234, r3=3.600000, r4=4.100000, &end
# Atom 1: HA CYS 14, Atom 2: HND2 ASN 17
 &rst iat=179, 235, r3=3.600000, r4=4.100000, &end
# Atom 1: HA CYS 14, Atom 2: HN CYS 20
 &rst iat=179, 271, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 14, Atom 2: HNE1 GLN 21
 &rst iat=179, 295, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 14, Atom 2: HB2 CYS 38
 &rst iat=179, 516, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 14, Atom 2: HN LYS 15
 &rst iat=181, 189, r3=4.500000, r4=5.000000, &end
# Atom 1: HB2 CYS 14, Atom 2: HB2 LYS 15
 &rst iat=181, 193, r3=4.800000, r4=5.300000, &end
# Atom 1: HB2 CYS 14, Atom 2: HB3 LYS 15
 &rst iat=181, 194, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 14, Atom 2: QG LYS 15
 &rst iat=181, -1, r3=6.000000, r4=6.500000, igr2=196, 197, &end
# Atom 1: HB2 CYS 14, Atom 2: HND1 ASN 17
 &rst iat=181, 234, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 14, Atom 2: HN LYS 15
 &rst iat=182, 189, r3=5.000000, r4=5.500000, &end
# Atom 1: HB3 CYS 14, Atom 2: HB2 LYS 15
 &rst iat=182, 193, r3=5.500000, r4=6.000000, &end
# Atom 1: HB3 CYS 14, Atom 2: HNE1 GLN 21
 &rst iat=182, 295, r3=6.000000, r4=6.500000, &end
# Atom 1: HN LYS 15, Atom 2: HA LYS 15
 &rst iat=189, 191, r3=3.800000, r4=4.300000, &end
# Atom 1: HN LYS 15, Atom 2: HB2 LYS 15
 &rst iat=189, 193, r3=3.300000, r4=3.800000, &end
# Atom 1: HN LYS 15, Atom 2: HB3 LYS 15
 &rst iat=189, 194, r3=4.300000, r4=4.800000, &end
# Atom 1: HN LYS 15, Atom 2: QG LYS 15
 &rst iat=189, -1, r3=4.300000, r4=4.800000, igr2=196, 197, &end
# Atom 1: HN LYS 15, Atom 2: QE LYS 15
 &rst iat=189, -1, r3=6.500000, r4=7.000000, igr2=202, 203, &end
# Atom 1: HN LYS 15, Atom 2: HN ASN 17
 &rst iat=189, 225, r3=5.600000, r4=6.100000, &end
# Atom 1: HA LYS 15, Atom 2: HB2 LYS 15
 &rst iat=191, 193, r3=3.200000, r4=3.700000, &end
# Atom 1: HA LYS 15, Atom 2: HB3 LYS 15
 &rst iat=191, 194, r3=4.000000, r4=4.500000, &end
# Atom 1: HA LYS 15, Atom 2: QG LYS 15
 &rst iat=191, -1, r3=3.900000, r4=4.400000, igr2=196, 197, &end
# Atom 1: HA LYS 15, Atom 2: QE LYS 15
 &rst iat=191, -1, r3=6.000000, r4=6.500000, igr2=202, 203, &end
# Atom 1: HA LYS 15, Atom 2: HND1 ASN 16
 &rst iat=191, 220, r3=5.200000, r4=5.700000, &end
# Atom 1: HA LYS 15, Atom 2: HN ASN 17
 &rst iat=191, 225, r3=6.000000, r4=6.500000, &end
# Atom 1: HA LYS 15, Atom 2: HND2 ASN 17
 &rst iat=191, 235, r3=6.000000, r4=6.500000, &end
# Atom 1: HA LYS 15, Atom 2: HNE2 GLN 21
 &rst iat=191, 296, r3=4.300000, r4=4.800000, &end
# Atom 1: HB2 LYS 15, Atom 2: QG LYS 15
 &rst iat=193, -1, r3=4.200000, r4=4.700000, igr2=196, 197, &end
# Atom 1: HB2 LYS 15, Atom 2: QE LYS 15
 &rst iat=193, -1, r3=4.100000, r4=4.600000, igr2=202, 203, &end
# Atom 1: HB2 LYS 15, Atom 2: HND1 ASN 16
 &rst iat=193, 220, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 LYS 15, Atom 2: HND2 ASN 16
 &rst iat=193, 221, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 LYS 15, Atom 2: QG LYS 15
 &rst iat=194, -1, r3=3.800000, r4=4.300000, igr2=196, 197, &end
# Atom 1: HB3 LYS 15, Atom 2: QE LYS 15
 &rst iat=194, -1, r3=4.500000, r4=5.000000, igr2=202, 203, &end
# Atom 1: QG LYS 15, Atom 2: QE LYS 15
 &rst iat=-1, -1, r3=5.900000, r4=6.400000, 
 igr1=196, 197, igr2=202, 203, &end
# Atom 1: QG LYS 15, Atom 2: HND1 ASN 16
 &rst iat=-1, 220, r3=5.800000, r4=6.300000, igr1=196, 197, &end
# Atom 1: QG LYS 15, Atom 2: HND2 ASN 16
 &rst iat=-1, 221, r3=7.000000, r4=7.500000, igr1=196, 197, &end
# Atom 1: HA ASN 16, Atom 2: HB2 ASN 16
 &rst iat=213, 215, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ASN 16, Atom 2: HB3 ASN 16
 &rst iat=213, 216, r3=5.900000, r4=6.400000, &end
# Atom 1: HA ASN 16, Atom 2: HND2 ASN 16
 &rst iat=213, 221, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ASN 16, Atom 2: HN GLU 18
 &rst iat=213, 239, r3=5.800000, r4=6.300000, &end
# Atom 1: HB2 ASN 16, Atom 2: HND1 ASN 16
 &rst iat=215, 220, r3=3.400000, r4=3.900000, &end
# Atom 1: HB2 ASN 16, Atom 2: HND2 ASN 16
 &rst iat=215, 221, r3=4.300000, r4=4.800000, &end
# Atom 1: HB3 ASN 16, Atom 2: HND1 ASN 16
 &rst iat=216, 220, r3=3.100000, r4=3.600000, &end
# Atom 1: HB3 ASN 16, Atom 2: HND2 ASN 16
 &rst iat=216, 221, r3=4.100000, r4=4.600000, &end
# Atom 1: HND1 ASN 16, Atom 2: HN ASN 17
 &rst iat=220, 225, r3=3.800000, r4=4.300000, &end
# Atom 1: HND1 ASN 16, Atom 2: HND1 ASN 17
 &rst iat=220, 234, r3=4.800000, r4=5.300000, &end
# Atom 1: HND1 ASN 16, Atom 2: HND2 ASN 17
 &rst iat=220, 235, r3=4.300000, r4=4.800000, &end
# Atom 1: HND2 ASN 16, Atom 2: HN ASN 17
 &rst iat=221, 225, r3=4.400000, r4=4.900000, &end
# Atom 1: HND2 ASN 16, Atom 2: HND1 ASN 17
 &rst iat=221, 234, r3=3.900000, r4=4.400000, &end
# Atom 1: HND2 ASN 16, Atom 2: HND2 ASN 17
 &rst iat=221, 235, r3=3.400000, r4=3.900000, &end
# Atom 1: HND2 ASN 16, Atom 2: HB3 ASN 40
 &rst iat=221, 536, r3=5.700000, r4=6.200000, &end
# Atom 1: HN ASN 17, Atom 2: HA ASN 17
 &rst iat=225, 227, r3=5.500000, r4=6.000000, &end
# Atom 1: HN ASN 17, Atom 2: HB2 ASN 17
 &rst iat=225, 229, r3=5.400000, r4=5.900000, &end
# Atom 1: HN ASN 17, Atom 2: HB3 ASN 17
 &rst iat=225, 230, r3=4.700000, r4=5.200000, &end
# Atom 1: HN ASN 17, Atom 2: HND1 ASN 17
 &rst iat=225, 234, r3=4.100000, r4=4.600000, &end
# Atom 1: HN ASN 17, Atom 2: HND2 ASN 17
 &rst iat=225, 235, r3=5.200000, r4=5.700000, &end
# Atom 1: HN ASN 17, Atom 2: HN GLU 18
 &rst iat=225, 239, r3=6.000000, r4=6.500000, &end
# Atom 1: HN ASN 17, Atom 2: HG2 GLN 21
 &rst iat=225, 290, r3=6.000000, r4=6.500000, &end
# Atom 1: HN ASN 17, Atom 2: HNE1 GLN 21
 &rst iat=225, 295, r3=4.400000, r4=4.900000, &end
# Atom 1: HA ASN 17, Atom 2: HB2 ASN 17
 &rst iat=227, 229, r3=4.500000, r4=5.000000, &end
# Atom 1: HA ASN 17, Atom 2: HB3 ASN 17
 &rst iat=227, 230, r3=5.200000, r4=5.700000, &end
# Atom 1: HA ASN 17, Atom 2: HND1 ASN 17
 &rst iat=227, 234, r3=4.700000, r4=5.200000, &end
# Atom 1: HA ASN 17, Atom 2: HND2 ASN 17
 &rst iat=227, 235, r3=6.000000, r4=6.500000, &end
# Atom 1: HA ASN 17, Atom 2: HN GLU 18
 &rst iat=227, 239, r3=3.400000, r4=3.900000, &end
# Atom 1: HA ASN 17, Atom 2: QB GLU 18
 &rst iat=227, -1, r3=6.500000, r4=7.000000, igr2=243, 244, &end
# Atom 1: HA ASN 17, Atom 2: HN GLN 19
 &rst iat=227, 254, r3=5.900000, r4=6.400000, &end
# Atom 1: HA ASN 17, Atom 2: HN CYS 20
 &rst iat=227, 271, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 ASN 17, Atom 2: HND1 ASN 17
 &rst iat=229, 234, r3=3.600000, r4=4.100000, &end
# Atom 1: HB2 ASN 17, Atom 2: HND2 ASN 17
 &rst iat=229, 235, r3=4.300000, r4=4.800000, &end
# Atom 1: HB2 ASN 17, Atom 2: HN GLU 18
 &rst iat=229, 239, r3=5.200000, r4=5.700000, &end
# Atom 1: HB3 ASN 17, Atom 2: HND1 ASN 17
 &rst iat=230, 234, r3=3.300000, r4=3.800000, &end
# Atom 1: HB3 ASN 17, Atom 2: HND2 ASN 17
 &rst iat=230, 235, r3=4.200000, r4=4.700000, &end
# Atom 1: HB3 ASN 17, Atom 2: HN GLU 18
 &rst iat=230, 239, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 ASN 17, Atom 2: HN CYS 20
&rst iat=230, 271, r3=4.200000, r4=4.700000, &end
# Atom 1: HB3 ASN 17, Atom 2: HB3 CYS 20
 &rst iat=230, 271, r3=4.400000, r4=4.900000, &end
# Atom 1: HB3 ASN 17, Atom 2: HNE1 GLN 21
 &rst iat=230, 295, r3=5.500000, r4=6.000000, &end
# Atom 1: HND1 ASN 17, Atom 2: QB GLN 19
 &rst iat=234, -1, r3=5.900000, r4=6.400000, igr2=258, 259, &end
# Atom 1: HND1 ASN 17, Atom 2: HB2 CYS 20
 &rst iat=234, 275, r3=6.000000, r4=6.500000, &end
# Atom 1: HND1 ASN 17, Atom 2: HB3 CYS 20
 &rst iat=234, 276, r3=4.700000, r4=5.200000, &end
# Atom 1: HND1 ASN 17, Atom 2: HNE2 GLN 21
 &rst iat=234, 296, r3=5.500000, r4=6.000000, &end
# Atom 1: HND2 ASN 17, Atom 2: QB GLN 19
 &rst iat=235, -1, r3=5.400000, r4=5.900000, igr2=258, 259, &end
# Atom 1: HND2 ASN 17, Atom 2: HB2 CYS 20
 &rst iat=235, 275, r3=6.000000, r4=6.500000, &end
# Atom 1: HND2 ASN 17, Atom 2: HB3 CYS 20
 &rst iat=235, 276, r3=4.400000, r4=4.900000, &end
# Atom 1: HND2 ASN 17, Atom 2: HB2 GLN 21
 &rst iat=235, 287, r3=6.000000, r4=6.500000, &end
# Atom 1: HND2 ASN 17, Atom 2: HG3 GLN 21
 &rst iat=235, 291, r3=6.000000, r4=6.500000, &end
# Atom 1: HND2 ASN 17, Atom 2: HNE1 GLN 21
 &rst iat=235, 295, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLU 18, Atom 2: HA GLU 18
 &rst iat=239, 241, r3=3.900000, r4=4.400000, &end
# Atom 1: HN GLU 18, Atom 2: QB GLU 18
 &rst iat=239, -1, r3=4.200000, r4=4.700000, igr2=243, 244, &end
# Atom 1: HN GLU 18, Atom 2: HG2 GLU 18
 &rst iat=239, 246, r3=4.000000, r4=4.500000, &end
# Atom 1: HN GLU 18, Atom 2: HG3 GLU 18
 &rst iat=239, 247, r3=3.300000, r4=3.800000, &end
# Atom 1: HN GLU 18, Atom 2: HN GLN 19
 &rst iat=239, 254, r3=4.000000, r4=4.500000, &end
# Atom 1: HN GLU 18, Atom 2: HA GLN 19
 &rst iat=239, 256, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLU 18, Atom 2: QB GLN 19
 &rst iat=239, -1, r3=7.000000, r4=7.500000, igr2=258, 259, &end
# Atom 1: HN GLU 18, Atom 2: QG GLN 19
 &rst iat=239, -1, r3=7.000000, r4=7.500000, igr2=261, 262, &end
# Atom 1: HN GLU 18, Atom 2: HN CYS 20
 &rst iat=239, 271, r3=5.400000, r4=5.900000, &end
# Atom 1: HN GLU 18, Atom 2: HN GLN 21
 &rst iat=239, 283, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLU 18, Atom 2: HG2 GLN 21
 &rst iat=239, 290, r3=5.600000, r4=6.100000, &end
# Atom 1: HN GLU 18, Atom 2: HG3 GLN 21
 &rst iat=239, 291, r3=5.800000, r4=6.300000, &end
# Atom 1: HN GLU 18, Atom 2: HNE1 GLN 21
 &rst iat=239, 295, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLU 18, Atom 2: QB GLU 18
 &rst iat=241, -1, r3=4.500000, r4=5.000000, igr2=243, 244, &end
# Atom 1: HA GLU 18, Atom 2: HG2 GLU 18
 &rst iat=241, 246, r3=3.500000, r4=4.000000, &end
# Atom 1: HA GLU 18, Atom 2: HG3 GLU 18
 &rst iat=241, 247, r3=3.600000, r4=4.100000, &end
# Atom 1: HA GLU 18, Atom 2: HN GLN 19
 &rst iat=241, 254, r3=5.200000, r4=5.700000, &end
# Atom 1: HA GLU 18, Atom 2: HN CYS 20
 &rst iat=241, 271, r3=4.800000, r4=5.300000, &end
# Atom 1: HA GLU 18, Atom 2: HN GLN 21
 &rst iat=241, 283, r3=4.500000, r4=5.000000, &end
# Atom 1: HA GLU 18, Atom 2: HB2 GLN 21
 &rst iat=241, 287, r3=3.500000, r4=4.000000, &end
# Atom 1: HA GLU 18, Atom 2: HB3 GLN 21
 &rst iat=241, 288, r3=4.600000, r4=5.100000, &end
# Atom 1: HA GLU 18, Atom 2: HG2 GLN 21
 &rst iat=241, 290, r3=3.000000, r4=3.500000, &end
# Atom 1: HA GLU 18, Atom 2: HG3 GLN 21
 &rst iat=241, 291, r3=3.700000, r4=4.200000, &end
# Atom 1: HA GLU 18, Atom 2: HNE1 GLN 21
 &rst iat=241, 295, r3=4.200000, r4=4.700000, &end
# Atom 1: QB GLU 18, Atom 2: HG2 GLU 18
 &rst iat=-1, 246, r3=3.400000, r4=3.900000, igr1=243, 244, &end
# Atom 1: QB GLU 18, Atom 2: HG3 GLU 18
 &rst iat=-1, 247, r3=3.800000, r4=4.300000, igr1=243, 244, &end
# Atom 1: QB GLU 18, Atom 2: HN GLN 19
 &rst iat=-1, 254, r3=5.400000, r4=5.900000, igr1=243, 244, &end
# Atom 1: QB GLU 18, Atom 2: HNE1 GLN 19
 &rst iat=-1, 266, r3=7.000000, r4=7.500000, igr1=243, 244, &end
# Atom 1: QB GLU 18, Atom 2: HNE2 GLN 19
 &rst iat=-1, 267, r3=7.000000, r4=7.500000, igr1=243, 244, &end
# Atom 1: QB GLU 18, Atom 2: HN CYS 20
 &rst iat=-1, 271, r3=6.300000, r4=6.800000, igr1=243, 244, &end
# Atom 1: HG2 GLU 18, Atom 2: HN GLN 19
 &rst iat=246, 254, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 GLU 18, Atom 2: HG2 GLN 21
 &rst iat=246, 290, r3=4.100000, r4=4.600000, &end
# Atom 1: HG3 GLU 18, Atom 2: HN GLN 19
 &rst iat=247, 254, r3=5.700000, r4=6.200000, &end
# Atom 1: HG3 GLU 18, Atom 2: HG2 GLN 21
 &rst iat=247, 290, r3=4.300000, r4=4.800000, &end
# Atom 1: HG3 GLU 18, Atom 2: HNE1 GLN 21
 &rst iat=247, 295, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLN 19, Atom 2: HA GLN 19
 &rst iat=254, 256, r3=3.900000, r4=4.400000, &end
# Atom 1: HN GLN 19, Atom 2: QB GLN 19
 &rst iat=254, -1, r3=4.300000, r4=4.800000, igr2=258, 259, &end
# Atom 1: HN GLN 19, Atom 2: QG GLN 19
 &rst iat=254, -1, r3=4.400000, r4=4.900000, igr2=261, 262, &end
# Atom 1: HN GLN 19, Atom 2: HNE1 GLN 19
 &rst iat=254, 266, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLN 19, Atom 2: HN CYS 20
 &rst iat=254, 271, r3=3.500000, r4=4.000000, &end
# Atom 1: HN GLN 19, Atom 2: HA CYS 20
 &rst iat=254, 273, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLN 19, Atom 2: HB3 CYS 20
 &rst iat=254, 276, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLN 19, Atom 2: HN GLN 21
 &rst iat=254, 283, r3=5.200000, r4=5.700000, &end
# Atom 1: HA GLN 19, Atom 2: QB GLN 19
 &rst iat=256, -1, r3=4.900000, r4=5.400000, igr2=258, 259, &end
# Atom 1: HA GLN 19, Atom 2: QG GLN 19
 &rst iat=256, -1, r3=4.500000, r4=5.000000, igr2=261, 262, &end
# Atom 1: HA GLN 19, Atom 2: HNE1 GLN 19
 &rst iat=256, 266, r3=5.800000, r4=6.300000, &end
# Atom 1: HA GLN 19, Atom 2: HN CYS 20
 &rst iat=256, 271, r3=4.400000, r4=4.900000, &end
# Atom 1: HA GLN 19, Atom 2: HA CYS 20
 &rst iat=256, 273, r3=6.000000, r4=6.500000, &end
# Atom 1: QB GLN 19, Atom 2: QG GLN 19
 &rst iat=-1, -1, r3=5.300000, r4=5.800000, 
 igr1=258, 259, igr2=261, 262, &end
# Atom 1: QB GLN 19, Atom 2: HNE1 GLN 19
 &rst iat=-1, 266, r3=5.900000, r4=6.400000, igr1=258, 259, &end
# Atom 1: QB GLN 19, Atom 2: HNE2 GLN 19
 &rst iat=-1, 267, r3=7.000000, r4=7.500000, igr1=258, 259, &end
# Atom 1: QB GLN 19, Atom 2: HN CYS 20
 &rst iat=-1, 271, r3=5.500000, r4=6.000000, igr1=258, 259, &end
# Atom 1: QG GLN 19, Atom 2: HNE1 GLN 19
 &rst iat=-1, 266, r3=4.600000, r4=5.100000, igr1=261, 262, &end
# Atom 1: QG GLN 19, Atom 2: HNE2 GLN 19
 &rst iat=-1, 267, r3=5.700000, r4=6.200000, igr1=261, 262, &end
# Atom 1: QG GLN 19, Atom 2: HN CYS 20
 &rst iat=-1, 271, r3=5.700000, r4=6.200000, igr1=261, 262, &end
# Atom 1: HNE2 GLN 19, Atom 2: HN SER 23
 &rst iat=267, 322, r3=5.400000, r4=5.900000, &end
# Atom 1: HN CYS 20, Atom 2: HA CYS 20
 &rst iat=271, 273, r3=4.000000, r4=4.500000, &end
# Atom 1: HN CYS 20, Atom 2: HB2 CYS 20
 &rst iat=271, 275, r3=4.800000, r4=5.300000, &end
# Atom 1: HN CYS 20, Atom 2: HB3 CYS 20
 &rst iat=271, 276, r3=4.000000, r4=4.500000, &end
# Atom 1: HN CYS 20, Atom 2: HN GLN 21
 &rst iat=271, 283, r3=3.200000, r4=3.700000, &end
# Atom 1: HN CYS 20, Atom 2: HB2 GLN 21
 &rst iat=271, 287, r3=5.700000, r4=6.200000, &end
# Atom 1: HN CYS 20, Atom 2: HNE1 GLN 21
 &rst iat=271, 295, r3=4.500000, r4=5.000000, &end
# Atom 1: HN CYS 20, Atom 2: HN LYS 22
 &rst iat=271, 300, r3=5.200000, r4=5.700000, &end
# Atom 1: HN CYS 20, Atom 2: HN SER 23
 &rst iat=271, 322, r3=5.600000, r4=6.100000, &end
# Atom 1: HA CYS 20, Atom 2: HB2 CYS 20
 &rst iat=273, 275, r3=3.300000, r4=3.800000, &end
# Atom 1: HA CYS 20, Atom 2: HB3 CYS 20
 &rst iat=273, 276, r3=3.300000, r4=3.800000, &end
# Atom 1: HA CYS 20, Atom 2: HN GLN 21
 &rst iat=273, 283, r3=4.000000, r4=4.500000, &end
# Atom 1: HA CYS 20, Atom 2: HA GLN 21
 &rst iat=273, 285, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 20, Atom 2: HN LYS 22
 &rst iat=273, 300, r3=4.100000, r4=4.600000, &end
# Atom 1: HA CYS 20, Atom 2: HN SER 23
 &rst iat=273, 322, r3=4.200000, r4=4.700000, &end
# Atom 1: HA CYS 20, Atom 2: QB SER 23
 &rst iat=273, -1, r3=6.500000, r4=7.000000, igr2=326, 327, &end
# Atom 1: HA CYS 20, Atom 2: HA CYS 24
 &rst iat=273, 335, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 20, Atom 2: HB2 CYS 24
 &rst iat=273, 337, r3=5.900000, r4=6.400000, &end
# Atom 1: HA CYS 20, Atom 2: HB3 CYS 24
 &rst iat=273, 338, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 20, Atom 2: HB2 ASN 40
 &rst iat=273, 535, r3=4.600000, r4=5.100000, &end
# Atom 1: HA CYS 20, Atom 2: HB3 ASN 40
 &rst iat=273, 536, r3=4.700000, r4=5.200000, &end
# Atom 1: HA CYS 20, Atom 2: HND1 ASN 40
 &rst iat=273, 540, r3=5.200000, r4=5.700000, &end
# Atom 1: HB2 CYS 20, Atom 2: HN GLN 21
 &rst iat=275, 283, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 20, Atom 2: HN LYS 22
 &rst iat=275, 300, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 20, Atom 2: HN SER 23
 &rst iat=275, 322, r3=5.900000, r4=6.400000, &end
# Atom 1: HB2 CYS 20, Atom 2: QB SER 23
 &rst iat=275, -1, r3=5.600000, r4=6.100000, igr2=326, 327, &end
# Atom 1: HB2 CYS 20, Atom 2: HN CYS 24
 &rst iat=275, 333, r3=5.400000, r4=5.900000, &end
# Atom 1: HB2 CYS 20, Atom 2: HA CYS 24
 &rst iat=275, 335, r3=3.600000, r4=4.100000, &end
# Atom 1: HB2 CYS 20, Atom 2: HB2 CYS 24
 &rst iat=275, 337, r3=3.600000, r4=4.100000, &end
# Atom 1: HB2 CYS 20, Atom 2: HB3 CYS 24
 &rst iat=275, 338, r3=4.200000, r4=4.700000, &end
# Atom 1: HB2 CYS 20, Atom 2: HN SER 25
 &rst iat=275, 345, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 20, Atom 2: HN GLN 21
 &rst iat=276, 283, r3=4.300000, r4=4.800000, &end
# Atom 1: HB3 CYS 20, Atom 2: HN LYS 22
 &rst iat=276, 300, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 20, Atom 2: HN SER 23
 &rst iat=276, 322, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 20, Atom 2: QB SER 23
 &rst iat=276, -1, r3=7.000000, r4=7.500000, igr2=326, 327, &end
# Atom 1: HB3 CYS 20, Atom 2: HA CYS 24
 &rst iat=276, 335, r3=4.600000, r4=5.100000, &end
# Atom 1: HB3 CYS 20, Atom 2: HB2 CYS 24
 &rst iat=276, 337, r3=4.200000, r4=4.700000, &end
# Atom 1: HN GLN 21, Atom 2: HA GLN 21
 &rst iat=283, 285, r3=3.800000, r4=4.300000, &end
# Atom 1: HN GLN 21, Atom 2: HB2 GLN 21
 &rst iat=283, 287, r3=3.400000, r4=3.900000, &end
# Atom 1: HN GLN 21, Atom 2: HB3 GLN 21
 &rst iat=283, 288, r3=3.600000, r4=4.100000, &end
# Atom 1: HN GLN 21, Atom 2: HG2 GLN 21
 &rst iat=283, 290, r3=3.100000, r4=3.600000, &end
# Atom 1: HN GLN 21, Atom 2: HG3 GLN 21
 &rst iat=283, 291, r3=3.600000, r4=4.100000, &end
# Atom 1: HN GLN 21, Atom 2: HNE1 GLN 21
 &rst iat=283, 295, r3=4.000000, r4=4.500000, &end
# Atom 1: HN GLN 21, Atom 2: HNE2 GLN 21
 &rst iat=283, 296, r3=5.400000, r4=5.900000, &end
# Atom 1: HN GLN 21, Atom 2: HN LYS 22
 &rst iat=283, 300, r3=3.500000, r4=4.000000, &end
# Atom 1: HN GLN 21, Atom 2: HB2 LYS 22
 &rst iat=283, 304, r3=6.000000, r4=6.500000, &end
# Atom 1: HA GLN 21, Atom 2: HB2 GLN 21
 &rst iat=285, 287, r3=3.900000, r4=4.400000, &end
# Atom 1: HA GLN 21, Atom 2: HB3 GLN 21
 &rst iat=285, 288, r3=3.600000, r4=4.100000, &end
# Atom 1: HA GLN 21, Atom 2: HG2 GLN 21
 &rst iat=285, 290, r3=4.100000, r4=4.600000, &end
# Atom 1: HA GLN 21, Atom 2: HG3 GLN 21
 &rst iat=285, 291, r3=4.400000, r4=4.900000, &end
# Atom 1: HA GLN 21, Atom 2: HNE1 GLN 21
 &rst iat=285, 295, r3=4.300000, r4=4.800000, &end
# Atom 1: HA GLN 21, Atom 2: HNE2 GLN 21
 &rst iat=285, 296, r3=5.900000, r4=6.400000, &end
# Atom 1: HA GLN 21, Atom 2: HN LYS 22
 &rst iat=285, 300, r3=4.800000, r4=5.300000, &end
# Atom 1: HA GLN 21, Atom 2: HN SER 23
 &rst iat=285, 322, r3=4.500000, r4=5.000000, &end
# Atom 1: HA GLN 21, Atom 2: HN CYS 24
 &rst iat=285, 333, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 GLN 21, Atom 2: HG2 GLN 21
 &rst iat=287, 290, r3=2.800000, r4=3.300000, &end
# Atom 1: HB2 GLN 21, Atom 2: HG3 GLN 21
 &rst iat=287, 291, r3=2.900000, r4=3.400000, &end
# Atom 1: HB2 GLN 21, Atom 2: HNE1 GLN 21
 &rst iat=287, 295, r3=4.500000, r4=5.000000, &end
# Atom 1: HB2 GLN 21, Atom 2: HN LYS 22
 &rst iat=287, 300, r3=4.100000, r4=4.600000, &end
# Atom 1: HB3 GLN 21, Atom 2: HG2 GLN 21
 &rst iat=288, 290, r3=3.000000, r4=3.500000, &end
# Atom 1: HB3 GLN 21, Atom 2: HG3 GLN 21
 &rst iat=288, 291, r3=2.900000, r4=3.400000, &end
# Atom 1: HB3 GLN 21, Atom 2: HNE1 GLN 21
 &rst iat=288, 295, r3=4.800000, r4=5.300000, &end
# Atom 1: HB3 GLN 21, Atom 2: HN LYS 22
 &rst iat=288, 300, r3=4.300000, r4=4.800000, &end
# Atom 1: HB3 GLN 21, Atom 2: HG2 LYS 22
 &rst iat=288, 307, r3=4.300000, r4=4.800000, &end
# Atom 1: HB3 GLN 21, Atom 2: HG3 LYS 22
 &rst iat=288, 308, r3=4.700000, r4=5.200000, &end
# Atom 1: HG2 GLN 21, Atom 2: HNE1 GLN 21
 &rst iat=290, 295, r3=2.800000, r4=3.300000, &end
# Atom 1: HG2 GLN 21, Atom 2: HNE2 GLN 21
 &rst iat=290, 296, r3=4.000000, r4=4.500000, &end
# Atom 1: HG2 GLN 21, Atom 2: HN LYS 22
 &rst iat=290, 300, r3=5.700000, r4=6.200000, &end
# Atom 1: HG2 GLN 21, Atom 2: QE LYS 22
 &rst iat=290, -1, r3=5.700000, r4=6.200000, igr2=313, 314, &end
# Atom 1: HG3 GLN 21, Atom 2: HNE1 GLN 21
 &rst iat=291, 295, r3=3.300000, r4=3.800000, &end
# Atom 1: HG3 GLN 21, Atom 2: HNE2 GLN 21
 &rst iat=291, 296, r3=4.900000, r4=5.400000, &end
# Atom 1: HG3 GLN 21, Atom 2: HN LYS 22
 &rst iat=291, 300, r3=5.900000, r4=6.400000, &end
# Atom 1: HG3 GLN 21, Atom 2: HG2 LYS 22
 &rst iat=291, 307, r3=4.800000, r4=5.300000, &end
# Atom 1: HG3 GLN 21, Atom 2: QE LYS 22
 &rst iat=291, -1, r3=4.900000, r4=5.400000, igr2=313, 314, &end
# Atom 1: HNE2 GLN 21, Atom 2: HB2 CYS 24
 &rst iat=296, 337, r3=6.000000, r4=6.500000, &end
# Atom 1: HN LYS 22, Atom 2: HA LYS 22
 &rst iat=300, 302, r3=3.300000, r4=3.800000, &end
# Atom 1: HN LYS 22, Atom 2: HB2 LYS 22
 &rst iat=300, 304, r3=3.500000, r4=4.000000, &end
# Atom 1: HN LYS 22, Atom 2: HB3 LYS 22
 &rst iat=300, 305, r3=4.400000, r4=4.900000, &end
# Atom 1: HN LYS 22, Atom 2: HG2 LYS 22
 &rst iat=300, 307, r3=3.400000, r4=3.900000, &end
# Atom 1: HN LYS 22, Atom 2: HG3 LYS 22
 &rst iat=300, 308, r3=3.500000, r4=4.000000, &end
# Atom 1: HN LYS 22, Atom 2: QE LYS 22
 &rst iat=300, -1, r3=6.500000, r4=7.000000, igr2=313, 314, &end
# Atom 1: HN LYS 22, Atom 2: HN SER 23
 &rst iat=300, 322, r3=3.400000, r4=3.900000, &end
# Atom 1: HN LYS 22, Atom 2: QB SER 23
 &rst iat=300, -1, r3=6.000000, r4=6.500000, igr2=326, 327, &end
# Atom 1: HA LYS 22, Atom 2: HB2 LYS 22
 &rst iat=302, 304, r3=3.800000, r4=4.300000, &end
# Atom 1: HA LYS 22, Atom 2: HB3 LYS 22
 &rst iat=302, 305, r3=3.400000, r4=3.900000, &end
# Atom 1: HA LYS 22, Atom 2: HG2 LYS 22
 &rst iat=302, 307, r3=3.400000, r4=3.900000, &end
# Atom 1: HA LYS 22, Atom 2: HG3 LYS 22
 &rst iat=302, 308, r3=4.000000, r4=4.500000, &end
# Atom 1: HA LYS 22, Atom 2: QE LYS 22
 &rst iat=302, -1, r3=6.900000, r4=7.400000, igr2=313, 314, &end
# Atom 1: HA LYS 22, Atom 2: HN SER 23
 &rst iat=302, 322, r3=4.200000, r4=4.700000, &end
# Atom 1: HA LYS 22, Atom 2: HN CYS 24
 &rst iat=302, 333, r3=5.300000, r4=5.800000, &end
# Atom 1: HB2 LYS 22, Atom 2: HG2 LYS 22
 &rst iat=304, 307, r3=3.100000, r4=3.600000, &end
# Atom 1: HB2 LYS 22, Atom 2: HG3 LYS 22
 &rst iat=304, 308, r3=2.500000, r4=3.000000, &end
# Atom 1: HB2 LYS 22, Atom 2: QE LYS 22
 &rst iat=304, -1, r3=4.400000, r4=4.900000, igr2=313, 314, &end
# Atom 1: HB2 LYS 22, Atom 2: HN SER 23
 &rst iat=304, 322, r3=4.800000, r4=5.300000, &end
# Atom 1: HB3 LYS 22, Atom 2: HG2 LYS 22
 &rst iat=305, 307, r3=2.900000, r4=3.400000, &end
# Atom 1: HB3 LYS 22, Atom 2: HG3 LYS 22
 &rst iat=305, 308, r3=3.000000, r4=3.500000, &end
# Atom 1: HB3 LYS 22, Atom 2: QE LYS 22
 &rst iat=305, -1, r3=5.600000, r4=6.100000, igr2=313, 314, &end
# Atom 1: HB3 LYS 22, Atom 2: HN SER 23
 &rst iat=305, 322, r3=5.100000, r4=5.600000, &end
# Atom 1: HB3 LYS 22, Atom 2: QB SER 23
 &rst iat=305, -1, r3=5.700000, r4=6.200000, igr2=326, 327, &end
# Atom 1: HG2 LYS 22, Atom 2: QE LYS 22
 &rst iat=307, -1, r3=4.400000, r4=4.900000, igr2=313, 314, &end
# Atom 1: HG2 LYS 22, Atom 2: HN SER 23
 &rst iat=307, 322, r3=4.700000, r4=5.200000, &end
# Atom 1: HG3 LYS 22, Atom 2: QE LYS 22
 &rst iat=308, -1, r3=4.800000, r4=5.300000, igr2=313, 314, &end
# Atom 1: HG3 LYS 22, Atom 2: HN SER 23
 &rst iat=308, 322, r3=5.400000, r4=5.900000, &end
# Atom 1: HN SER 23, Atom 2: HA SER 23
 &rst iat=322, 324, r3=4.000000, r4=4.500000, &end
# Atom 1: HN SER 23, Atom 2: QB SER 23
 &rst iat=322, -1, r3=4.900000, r4=5.400000, igr2=326, 327, &end
# Atom 1: HN SER 23, Atom 2: HN CYS 24
 &rst iat=322, 333, r3=4.300000, r4=4.800000, &end
# Atom 1: HN SER 23, Atom 2: HA CYS 24
 &rst iat=322, 335, r3=6.000000, r4=6.500000, &end
# Atom 1: HN SER 23, Atom 2: HB2 CYS 24
 &rst iat=322, 337, r3=6.000000, r4=6.500000, &end
# Atom 1: HN SER 23, Atom 2: HB3 CYS 24
 &rst iat=322, 338, r3=6.000000, r4=6.500000, &end
# Atom 1: HA SER 23, Atom 2: QB SER 23
 &rst iat=324, -1, r3=4.700000, r4=5.200000, igr2=326, 327, &end
# Atom 1: HA SER 23, Atom 2: HN CYS 24
 &rst iat=324, 333, r3=3.400000, r4=3.900000, &end
# Atom 1: HA SER 23, Atom 2: HA CYS 24
 &rst iat=324, 335, r3=5.400000, r4=5.900000, &end
# Atom 1: QB SER 23, Atom 2: HN CYS 24
 &rst iat=-1, 333, r3=6.400000, r4=6.900000, igr1=326, 327, &end
# Atom 1: QB SER 23, Atom 2: HA CYS 24
 &rst iat=-1, 335, r3=7.000000, r4=7.500000, igr1=326, 327, &end
# Atom 1: QB SER 23, Atom 2: HND1 ASN 40
 &rst iat=-1, 540, r3=5.400000, r4=5.900000, igr1=326, 327, &end
# Atom 1: QB SER 23, Atom 2: HND2 ASN 40
 &rst iat=-1, 541, r3=5.800000, r4=6.300000, igr1=326, 327, &end
# Atom 1: HN CYS 24, Atom 2: HA CYS 24
 &rst iat=333, 335, r3=4.300000, r4=4.800000, &end
# Atom 1: HN CYS 24, Atom 2: HB2 CYS 24
 &rst iat=333, 337, r3=4.000000, r4=4.500000, &end
# Atom 1: HN CYS 24, Atom 2: HB3 CYS 24
 &rst iat=333, 338, r3=3.600000, r4=4.100000, &end
# Atom 1: HN CYS 24, Atom 2: HN SER 25
 &rst iat=333, 345, r3=4.900000, r4=5.400000, &end
# Atom 1: HN CYS 24, Atom 2: HN CYS 26
 &rst iat=333, 356, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 24, Atom 2: HB2 CYS 24
 &rst iat=335, 337, r3=3.900000, r4=4.400000, &end
# Atom 1: HA CYS 24, Atom 2: HB3 CYS 24
 &rst iat=335, 338, r3=4.400000, r4=4.900000, &end
# Atom 1: HA CYS 24, Atom 2: HN SER 25
 &rst iat=335, 345, r3=3.300000, r4=3.800000, &end
# Atom 1: HA CYS 24, Atom 2: HN CYS 26
 &rst iat=335, 356, r3=4.700000, r4=5.200000, &end
# Atom 1: HA CYS 24, Atom 2: HN GLY 39
 &rst iat=335, 524, r3=4.100000, r4=4.600000, &end
# Atom 1: HB2 CYS 24, Atom 2: HN SER 25
 &rst iat=337, 345, r3=5.500000, r4=6.000000, &end
# Atom 1: HB2 CYS 24, Atom 2: HN CYS 26
 &rst iat=337, 356, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 24, Atom 2: HN SER 25
 &rst iat=338, 345, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 24, Atom 2: HN CYS 26
 &rst iat=338, 356, r3=5.300000, r4=5.800000, &end
# Atom 1: HN SER 25, Atom 2: HA SER 25
 &rst iat=345, 347, r3=4.400000, r4=4.900000, &end
# Atom 1: HN SER 25, Atom 2: HB2 SER 25
 &rst iat=345, 349, r3=4.300000, r4=4.800000, &end
# Atom 1: HN SER 25, Atom 2: HB3 SER 25
 &rst iat=345, 350, r3=4.700000, r4=5.200000, &end
# Atom 1: HN SER 25, Atom 2: HN CYS 26
 &rst iat=345, 356, r3=3.800000, r4=4.300000, &end
# Atom 1: HN SER 25, Atom 2: HB2 CYS 26
 &rst iat=345, 360, r3=6.000000, r4=6.500000, &end
# Atom 1: HN SER 25, Atom 2: HB2 PRO 37
 &rst iat=345, 506, r3=6.000000, r4=6.500000, &end
# Atom 1: HN SER 25, Atom 2: HN CYS 38
 &rst iat=345, 512, r3=5.500000, r4=6.000000, &end
# Atom 1: HN SER 25, Atom 2: HA CYS 38
 &rst iat=345, 514, r3=4.000000, r4=4.500000, &end
# Atom 1: HN SER 25, Atom 2: HN GLY 39
 &rst iat=345, 524, r3=4.000000, r4=4.500000, &end
# Atom 1: HA SER 25, Atom 2: HB2 SER 25
 &rst iat=347, 349, r3=3.900000, r4=4.400000, &end
# Atom 1: HA SER 25, Atom 2: HB3 SER 25
 &rst iat=347, 350, r3=3.500000, r4=4.000000, &end
# Atom 1: HA SER 25, Atom 2: HN CYS 26
 &rst iat=347, 356, r3=3.400000, r4=3.900000, &end
# Atom 1: HB2 SER 25, Atom 2: HN CYS 26
 &rst iat=349, 356, r3=5.500000, r4=6.000000, &end
# Atom 1: HB2 SER 25, Atom 2: HB2 PRO 37
 &rst iat=349, 506, r3=5.000000, r4=5.500000, &end
# Atom 1: HB2 SER 25, Atom 2: HA CYS 38
 &rst iat=349, 514, r3=4.000000, r4=4.500000, &end
# Atom 1: HB2 SER 25, Atom 2: HN GLY 39
 &rst iat=349, 524, r3=4.000000, r4=4.500000, &end
# Atom 1: HB3 SER 25, Atom 2: HN CYS 26
 &rst iat=350, 356, r3=5.700000, r4=6.200000, &end
# Atom 1: HN CYS 26, Atom 2: HA CYS 26
 &rst iat=356, 358, r3=4.200000, r4=4.700000, &end
# Atom 1: HN CYS 26, Atom 2: HB2 CYS 26
 &rst iat=356, 360, r3=3.500000, r4=4.000000, &end
# Atom 1: HN CYS 26, Atom 2: HB3 CYS 26
 &rst iat=356, 361, r3=4.300000, r4=4.800000, &end
# Atom 1: HN CYS 26, Atom 2: HA PRO 27
 &rst iat=356, 378, r3=5.500000, r4=6.000000, &end
# Atom 1: HN CYS 26, Atom 2: HD2 PRO 27
 &rst iat=356, 370, r3=5.100000, r4=5.600000, &end
# Atom 1: HN CYS 26, Atom 2: HD3 PRO 27
 &rst iat=356, 369, r3=5.900000, r4=6.400000, &end
# Atom 1: HN CYS 26, Atom 2: HB2 CYS 30
 &rst iat=356, 407, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 26, Atom 2: HB3 CYS 30
 &rst iat=356, 408, r3=5.700000, r4=6.200000, &end
# Atom 1: HN CYS 26, Atom 2: HN CYS 38
 &rst iat=356, 512, r3=6.500000, r4=7.000000, &end
# Atom 1: HN CYS 26, Atom 2: HA CYS 38
 &rst iat=356, 514, r3=5.700000, r4=6.200000, &end
# Atom 1: HN CYS 26, Atom 2: HN GLY 39
 &rst iat=356, 524, r3=6.500000, r4=7.000000, &end
# Atom 1: HA CYS 26, Atom 2: HB2 CYS 26
 &rst iat=358, 360, r3=4.900000, r4=5.400000, &end
# Atom 1: HA CYS 26, Atom 2: HB3 CYS 26
 &rst iat=358, 361, r3=3.900000, r4=4.400000, &end
# Atom 1: HA CYS 26, Atom 2: HD2 PRO 27
 &rst iat=358, 370, r3=3.000000, r4=3.500000, &end
# Atom 1: HA CYS 26, Atom 2: HD3 PRO 27
 &rst iat=358, 369, r3=2.700000, r4=3.200000, &end
# Atom 1: HA CYS 26, Atom 2: HB2 CYS 30
 &rst iat=358, 407, r3=5.300000, r4=5.800000, &end
# Atom 1: HA CYS 26, Atom 2: HB3 CYS 30
 &rst iat=358, 408, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 26, Atom 2: HB2 PRO 37
 &rst iat=358, 506, r3=5.700000, r4=6.200000, &end
# Atom 1: HA CYS 26, Atom 2: HB3 PRO 37
 &rst iat=358, 505, r3=5.400000, r4=5.900000, &end
# Atom 1: HA CYS 26, Atom 2: HG2 PRO 37
 &rst iat=358, 503, r3=3.800000, r4=4.300000, &end
# Atom 1: HA CYS 26, Atom 2: HG3 PRO 37
 &rst iat=358, 502, r3=3.500000, r4=4.000000, &end
# Atom 1: HA CYS 26, Atom 2: HD2 PRO 37
 &rst iat=358, 500, r3=5.000000, r4=5.500000, &end
# Atom 1: HA CYS 26, Atom 2: HD3 PRO 37
 &rst iat=358, 499, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 26, Atom 2: HD2 PRO 27
 &rst iat=360, 370, r3=4.600000, r4=5.100000, &end
# Atom 1: HB2 CYS 26, Atom 2: HN CYS 30
 &rst iat=360, 403, r3=5.000000, r4=5.500000, &end
# Atom 1: HB2 CYS 26, Atom 2: HA CYS 30
 &rst iat=360, 405, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 26, Atom 2: HB3 CYS 30
 &rst iat=360, 408, r3=3.700000, r4=4.200000, &end
# Atom 1: HB2 CYS 26, Atom 2: HD2 PRO 37
 &rst iat=360, 500, r3=5.900000, r4=6.400000, &end
# Atom 1: HB2 CYS 26, Atom 2: HD3 PRO 37
 &rst iat=360, 499, r3=5.500000, r4=6.000000, &end
# Atom 1: HB3 CYS 26, Atom 2: HG2 PRO 27
 &rst iat=361, 373, r3=5.300000, r4=5.800000, &end
# Atom 1: HB3 CYS 26, Atom 2: HG3 PRO 27
 &rst iat=361, 372, r3=5.900000, r4=6.400000, &end
# Atom 1: HB3 CYS 26, Atom 2: HD2 PRO 27
 &rst iat=361, 370, r3=2.900000, r4=3.400000, &end
# Atom 1: HB3 CYS 26, Atom 2: HD3 PRO 27
 &rst iat=361, 369, r3=4.100000, r4=4.600000, &end
# Atom 1: HB3 CYS 26, Atom 2: HN CYS 30
 &rst iat=361, 403, r3=5.300000, r4=5.800000, &end
# Atom 1: HB3 CYS 26, Atom 2: HA CYS 30
 &rst iat=361, 405, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 26, Atom 2: HB2 CYS 30
 &rst iat=361, 407, r3=3.700000, r4=4.200000, &end
# Atom 1: HB3 CYS 26, Atom 2: HB3 CYS 30
 &rst iat=361, 408, r3=3.300000, r4=3.800000, &end
# Atom 1: HB3 CYS 26, Atom 2: HG3 PRO 37
 &rst iat=361, 502, r3=4.900000, r4=5.400000, &end
# Atom 1: HB3 CYS 26, Atom 2: HD3 PRO 37
 &rst iat=361, 499, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 26, Atom 2: HB2 CYS 38
 &rst iat=361, 516, r3=5.500000, r4=6.000000, &end
# Atom 1: HA PRO 27, Atom 2: HB2 PRO 27
 &rst iat=378, 376, r3=3.600000, r4=4.100000, &end
# Atom 1: HA PRO 27, Atom 2: HB3 PRO 27
 &rst iat=378, 375, r3=3.400000, r4=3.900000, &end
# Atom 1: HA PRO 27, Atom 2: HG2 PRO 27
 &rst iat=378, 373, r3=5.400000, r4=5.900000, &end
# Atom 1: HA PRO 27, Atom 2: HG3 PRO 27
 &rst iat=378, 372, r3=3.800000, r4=4.300000, &end
# Atom 1: HA PRO 27, Atom 2: HD2 PRO 27
 &rst iat=378, 370, r3=4.200000, r4=4.700000, &end
# Atom 1: HA PRO 27, Atom 2: HD3 PRO 27
 &rst iat=378, 369, r3=6.000000, r4=6.500000, &end
# Atom 1: HA PRO 27, Atom 2: HN THR 28
 &rst iat=378, 382, r3=3.200000, r4=3.700000, &end
# Atom 1: HA PRO 27, Atom 2: HA THR 28
 &rst iat=378, 384, r3=6.000000, r4=6.500000, &end
# Atom 1: HA PRO 27, Atom 2: QG THR 28
 &rst iat=378, -1, r3=7.000000, r4=7.500000, igr2=388, 389, 390, &end
# Atom 1: HA PRO 27, Atom 2: HN GLY 29
 &rst iat=378, 396, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 PRO 27, Atom 2: HG2 PRO 27
 &rst iat=376, 373, r3=2.300000, r4=2.800000, &end
# Atom 1: HB2 PRO 27, Atom 2: HG3 PRO 27
 &rst iat=376, 372, r3=2.800000, r4=3.300000, &end
# Atom 1: HB2 PRO 27, Atom 2: HD2 PRO 27
 &rst iat=376, 370, r3=4.100000, r4=4.600000, &end
# Atom 1: HB2 PRO 27, Atom 2: HD3 PRO 27
 &rst iat=376, 369, r3=4.400000, r4=4.900000, &end
# Atom 1: HB2 PRO 27, Atom 2: HN THR 28
 &rst iat=376, 382, r3=3.500000, r4=4.000000, &end
# Atom 1: HB2 PRO 27, Atom 2: HA THR 28
 &rst iat=376, 384, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 PRO 27, Atom 2: QG THR 28
 &rst iat=376, -1, r3=5.600000, r4=6.100000, igr2=388, 389, 390, &end
# Atom 1: HB2 PRO 27, Atom 2: HA3 GLY 29
 &rst iat=376, 399, r3=5.700000, r4=6.200000, &end
# Atom 1: HB2 PRO 27, Atom 2: HN CYS 30
 &rst iat=376, 403, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 PRO 27, Atom 2: HG2 PRO 27
 &rst iat=375, 373, r3=3.000000, r4=3.500000, &end
# Atom 1: HB3 PRO 27, Atom 2: HG3 PRO 27
 &rst iat=375, 372, r3=2.500000, r4=3.000000, &end
# Atom 1: HB3 PRO 27, Atom 2: HD2 PRO 27
 &rst iat=375, 370, r3=4.000000, r4=4.500000, &end
# Atom 1: HB3 PRO 27, Atom 2: HD3 PRO 27
 &rst iat=375, 369, r3=3.600000, r4=4.100000, &end
# Atom 1: HB3 PRO 27, Atom 2: HN THR 28
 &rst iat=375, 382, r3=4.000000, r4=4.500000, &end
# Atom 1: HB3 PRO 27, Atom 2: HA THR 28
 &rst iat=375, 384, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 PRO 27, Atom 2: QG THR 28
 &rst iat=375, -1, r3=6.400000, r4=6.900000, igr2=388, 389, 390, &end
# Atom 1: HB3 PRO 27, Atom 2: HA3 GLY 29
 &rst iat=375, 399, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 PRO 27, Atom 2: HD2 PRO 27
 &rst iat=373, 370, r3=2.900000, r4=3.400000, &end
# Atom 1: HG2 PRO 27, Atom 2: HD3 PRO 27
 &rst iat=373, 369, r3=3.500000, r4=4.000000, &end
# Atom 1: HG2 PRO 27, Atom 2: HN THR 28
 &rst iat=373, 382, r3=4.100000, r4=4.600000, &end
# Atom 1: HG2 PRO 27, Atom 2: HA THR 28
 &rst iat=373, 384, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 PRO 27, Atom 2: QG THR 28
 &rst iat=373, -1, r3=6.200000, r4=6.700000, igr2=388, 389, 390, &end
# Atom 1: HG2 PRO 27, Atom 2: HN GLY 29
 &rst iat=373, 396, r3=6.000000, r4=6.500000, &end
# Atom 1: HG2 PRO 27, Atom 2: HN CYS 30
 &rst iat=373, 403, r3=4.800000, r4=5.300000, &end
# Atom 1: HG2 PRO 27, Atom 2: HA CYS 30
 &rst iat=373, 405, r3=5.200000, r4=5.700000, &end
# Atom 1: HG2 PRO 27, Atom 2: HB2 CYS 30
 &rst iat=373, 407, r3=3.300000, r4=3.800000, &end
# Atom 1: HG2 PRO 27, Atom 2: HB3 CYS 30
 &rst iat=373, 408, r3=5.000000, r4=5.500000, &end
# Atom 1: HG2 PRO 27, Atom 2: HD3 PRO 37
 &rst iat=373, 499, r3=5.300000, r4=5.800000, &end
# Atom 1: HG3 PRO 27, Atom 2: HD2 PRO 27
 &rst iat=372, 370, r3=3.100000, r4=3.600000, &end
# Atom 1: HG3 PRO 27, Atom 2: HD3 PRO 27
 &rst iat=372, 369, r3=2.800000, r4=3.300000, &end
# Atom 1: HG3 PRO 27, Atom 2: HN THR 28
 &rst iat=372, 382, r3=4.900000, r4=5.400000, &end
# Atom 1: HG3 PRO 27, Atom 2: QG THR 28
 &rst iat=372, -1, r3=7.000000, r4=7.500000, igr2=388, 389, 390, &end
# Atom 1: HG3 PRO 27, Atom 2: HN CYS 30
 &rst iat=372, 403, r3=6.000000, r4=6.500000, &end
# Atom 1: HG3 PRO 27, Atom 2: HB2 CYS 30
 &rst iat=372, 407, r3=4.900000, r4=5.400000, &end
# Atom 1: HG3 PRO 27, Atom 2: HD3 PRO 37
 &rst iat=372, 499, r3=6.500000, r4=7.000000, &end
# Atom 1: HD2 PRO 27, Atom 2: HN GLY 29
 &rst iat=370, 396, r3=6.000000, r4=6.500000, &end
# Atom 1: HD2 PRO 27, Atom 2: HN CYS 30
 &rst iat=370, 403, r3=5.100000, r4=5.600000, &end
# Atom 1: HD2 PRO 27, Atom 2: HA CYS 30
 &rst iat=370, 405, r3=5.000000, r4=5.500000, &end
# Atom 1: HD2 PRO 27, Atom 2: HB2 CYS 30
 &rst iat=370, 407, r3=3.400000, r4=3.900000, &end
# Atom 1: HD2 PRO 27, Atom 2: HB3 CYS 30
 &rst iat=370, 408, r3=4.700000, r4=5.200000, &end
# Atom 1: HD2 PRO 27, Atom 2: HB2 PRO 37
 &rst iat=370, 506, r3=6.000000, r4=6.500000, &end
# Atom 1: HD2 PRO 27, Atom 2: HG2 PRO 37
 &rst iat=370, 503, r3=3.800000, r4=4.300000, &end
# Atom 1: HD2 PRO 27, Atom 2: HG3 PRO 37
 &rst iat=370, 502, r3=3.700000, r4=4.200000, &end
# Atom 1: HD2 PRO 27, Atom 2: HD2 PRO 37
 &rst iat=370, 500, r3=4.000000, r4=4.500000, &end
# Atom 1: HD2 PRO 27, Atom 2: HD3 PRO 37
 &rst iat=370, 499, r3=5.000000, r4=5.500000, &end
# Atom 1: HD3 PRO 27, Atom 2: HN THR 28
 &rst iat=369, 382, r3=6.000000, r4=6.500000, &end
# Atom 1: HD3 PRO 27, Atom 2: HB2 PRO 37
 &rst iat=369, 506, r3=5.200000, r4=5.700000, &end
# Atom 1: HD3 PRO 27, Atom 2: HG2 PRO 37
 &rst iat=369, 503, r3=3.100000, r4=3.600000, &end
# Atom 1: HD3 PRO 27, Atom 2: HG3 PRO 37
 &rst iat=369, 502, r3=3.400000, r4=3.900000, &end
# Atom 1: HD3 PRO 27, Atom 2: HD2 PRO 37
 &rst iat=369, 500, r3=4.900000, r4=5.400000, &end
# Atom 1: HN THR 28, Atom 2: HA THR 28
 &rst iat=382, 384, r3=3.900000, r4=4.400000, &end
# Atom 1: HN THR 28, Atom 2: HB THR 28
 &rst iat=382, 386, r3=3.600000, r4=4.100000, &end
# Atom 1: HN THR 28, Atom 2: QG THR 28
 &rst iat=382, -1, r3=4.200000, r4=4.700000, igr2=388, 389, 390, &end
# Atom 1: HN THR 28, Atom 2: HN GLY 29
 &rst iat=382, 396, r3=5.200000, r4=5.700000, &end
# Atom 1: HN THR 28, Atom 2: HA2 GLY 29
 &rst iat=382, 398, r3=6.000000, r4=6.500000, &end
# Atom 1: HN THR 28, Atom 2: HA3 GLY 29
 &rst iat=382, 399, r3=4.800000, r4=5.300000, &end
# Atom 1: HN THR 28, Atom 2: HN CYS 30
 &rst iat=382, 403, r3=6.000000, r4=6.500000, &end
# Atom 1: HA THR 28, Atom 2: HB THR 28
 &rst iat=384, 386, r3=3.500000, r4=4.000000, &end
# Atom 1: HA THR 28, Atom 2: QG THR 28
 &rst iat=384, -1, r3=3.700000, r4=4.200000, igr2=388, 389, 390, &end
# Atom 1: HA THR 28, Atom 2: HN GLY 29
 &rst iat=384, 396, r3=3.300000, r4=3.800000, &end
# Atom 1: HA THR 28, Atom 2: HA2 GLY 29
 &rst iat=384, 398, r3=5.500000, r4=6.000000, &end
# Atom 1: HA THR 28, Atom 2: HA3 GLY 29
 &rst iat=384, 399, r3=6.000000, r4=6.500000, &end
# Atom 1: HA THR 28, Atom 2: HN CYS 30
 &rst iat=384, 403, r3=4.100000, r4=4.600000, &end
# Atom 1: HB THR 28, Atom 2: QG THR 28
 &rst iat=386, -1, r3=3.500000, r4=4.000000, igr2=388, 389, 390, &end
# Atom 1: HB THR 28, Atom 2: HN GLY 29
 &rst iat=386, 396, r3=4.400000, r4=4.900000, &end
# Atom 1: QG THR 28, Atom 2: HN GLY 29
 &rst iat=-1, 396, r3=3.500000, r4=4.000000, igr1=388, 389, 390, &end
# Atom 1: QG THR 28, Atom 2: HA2 GLY 29
 &rst iat=-1, 398, r3=4.700000, r4=5.200000, igr1=388, 389, 390, &end
# Atom 1: QG THR 28, Atom 2: HA3 GLY 29
 &rst iat=-1, 399, r3=4.500000, r4=5.000000, igr1=388, 389, 390, &end
# Atom 1: QG THR 28, Atom 2: HN CYS 30
 &rst iat=-1, 403, r3=5.600000, r4=6.100000, igr1=388, 389, 390, &end
# Atom 1: HN GLY 29, Atom 2: HA2 GLY 29
 &rst iat=396, 398, r3=3.300000, r4=3.800000, &end
# Atom 1: HN GLY 29, Atom 2: HA3 GLY 29
 &rst iat=396, 399, r3=3.900000, r4=4.400000, &end
# Atom 1: HN GLY 29, Atom 2: HN CYS 30
 &rst iat=396, 403, r3=3.700000, r4=4.200000, &end
# Atom 1: HN GLY 29, Atom 2: HA CYS 30
 &rst iat=396, 405, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLY 29, Atom 2: HB2 CYS 30
 &rst iat=396, 407, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLY 29, Atom 2: HB3 CYS 30
 &rst iat=396, 408, r3=6.000000, r4=6.500000, &end
# Atom 1: HN GLY 29, Atom 2: HND2 ASN 31
 &rst iat=396, 425, r3=5.600000, r4=6.100000, &end
# Atom 1: HA2 GLY 29, Atom 2: HN CYS 30
 &rst iat=398, 403, r3=4.100000, r4=4.600000, &end
# Atom 1: HA2 GLY 29, Atom 2: HN ASN 31
 &rst iat=398, 415, r3=5.700000, r4=6.200000, &end
# Atom 1: HA2 GLY 29, Atom 2: HND1 ASN 31
 &rst iat=398, 424, r3=4.700000, r4=5.200000, &end
# Atom 1: HA2 GLY 29, Atom 2: HND2 ASN 31
 &rst iat=398, 425, r3=3.800000, r4=4.300000, &end
# Atom 1: HA3 GLY 29, Atom 2: HN CYS 30
 &rst iat=399, 403, r3=4.400000, r4=4.900000, &end
# Atom 1: HA3 GLY 29, Atom 2: HN ASN 31
 &rst iat=399, 415, r3=6.000000, r4=6.500000, &end
# Atom 1: HA3 GLY 29, Atom 2: HND1 ASN 31
 &rst iat=399, 424, r3=5.200000, r4=5.700000, &end
# Atom 1: HA3 GLY 29, Atom 2: HND2 ASN 31
 &rst iat=399, 425, r3=4.600000, r4=5.100000, &end
# Atom 1: HN CYS 30, Atom 2: HA CYS 30
 &rst iat=403, 405, r3=4.000000, r4=4.500000, &end
# Atom 1: HN CYS 30, Atom 2: HB2 CYS 30
 &rst iat=403, 407, r3=3.600000, r4=4.100000, &end
# Atom 1: HN CYS 30, Atom 2: HB3 CYS 30
 &rst iat=403, 408, r3=3.600000, r4=4.100000, &end
# Atom 1: HN CYS 30, Atom 2: HN ASN 31
 &rst iat=403, 415, r3=5.100000, r4=5.600000, &end
# Atom 1: HN CYS 30, Atom 2: HB2 ASN 31
 &rst iat=403, 419, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 30, Atom 2: HN SER 32
 &rst iat=403, 429, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 30, Atom 2: HB2 CYS 30
 &rst iat=405, 407, r3=3.600000, r4=4.100000, &end
# Atom 1: HA CYS 30, Atom 2: HB3 CYS 30
 &rst iat=405, 408, r3=4.600000, r4=5.100000, &end
# Atom 1: HA CYS 30, Atom 2: HN ASN 31
 &rst iat=405, 415, r3=3.200000, r4=3.700000, &end
# Atom 1: HA CYS 30, Atom 2: HN SER 32
 &rst iat=405, 429, r3=4.100000, r4=4.600000, &end
# Atom 1: HA CYS 30, Atom 2: HN LYS 35
 &rst iat=405, 464, r3=6.000000, r4=6.500000, &end
# Atom 1: HA CYS 30, Atom 2: HB2 LYS 35
 &rst iat=405, 468, r3=4.600000, r4=5.100000, &end
# Atom 1: HA CYS 30, Atom 2: HB3 LYS 35
 &rst iat=405, 469, r3=5.400000, r4=5.900000, &end
# Atom 1: HA CYS 30, Atom 2: HA CYS 36
 &rst iat=405, 488, r3=4.500000, r4=5.000000, &end
# Atom 1: HA CYS 30, Atom 2: HB2 CYS 36
 &rst iat=405, 490, r3=5.700000, r4=6.200000, &end
# Atom 1: HB2 CYS 30, Atom 2: HN ASN 31
 &rst iat=407, 415, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 30, Atom 2: HB3 LYS 35
 &rst iat=407, 469, r3=5.500000, r4=6.000000, &end
# Atom 1: HB2 CYS 30, Atom 2: HA CYS 36
 &rst iat=407, 488, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 30, Atom 2: HN ASN 31
 &rst iat=408, 415, r3=5.800000, r4=6.300000, &end
# Atom 1: HN ASN 31, Atom 2: HA ASN 31
 &rst iat=415, 417, r3=3.600000, r4=4.100000, &end
# Atom 1: HN ASN 31, Atom 2: HB2 ASN 31
 &rst iat=415, 419, r3=3.900000, r4=4.400000, &end
# Atom 1: HN ASN 31, Atom 2: HB3 ASN 31
 &rst iat=415, 420, r3=4.500000, r4=5.000000, &end
# Atom 1: HN ASN 31, Atom 2: HND1 ASN 31
 &rst iat=415, 424, r3=4.400000, r4=4.900000, &end
# Atom 1: HN ASN 31, Atom 2: HND2 ASN 31
 &rst iat=415, 425, r3=5.400000, r4=5.900000, &end
# Atom 1: HN ASN 31, Atom 2: HN SER 32
 &rst iat=415, 429, r3=3.300000, r4=3.800000, &end
# Atom 1: HN ASN 31, Atom 2: HA SER 32
 &rst iat=415, 431, r3=6.000000, r4=6.500000, &end
# Atom 1: HN ASN 31, Atom 2: HB2 SER 32
 &rst iat=415, 433, r3=5.900000, r4=6.400000, &end
# Atom 1: HN ASN 31, Atom 2: HB3 SER 32
 &rst iat=415, 434, r3=6.000000, r4=6.500000, &end
# Atom 1: HN ASN 31, Atom 2: HB2 LYS 35
 &rst iat=415, 468, r3=6.000000, r4=6.500000, &end
# Atom 1: HN ASN 31, Atom 2: HB3 LYS 35
 &rst iat=415, 469, r3=5.900000, r4=6.400000, &end
# Atom 1: HA ASN 31, Atom 2: HB2 ASN 31
 &rst iat=417, 419, r3=3.900000, r4=4.400000, &end
# Atom 1: HA ASN 31, Atom 2: HB3 ASN 31
 &rst iat=417, 420, r3=3.700000, r4=4.200000, &end
# Atom 1: HA ASN 31, Atom 2: HND1 ASN 31
 &rst iat=417, 424, r3=3.700000, r4=4.200000, &end
# Atom 1: HA ASN 31, Atom 2: HND2 ASN 31
 &rst iat=417, 425, r3=4.700000, r4=5.200000, &end
# Atom 1: HA ASN 31, Atom 2: HN SER 32
 &rst iat=417, 429, r3=3.200000, r4=3.700000, &end
# Atom 1: HB2 ASN 31, Atom 2: HND1 ASN 31
 &rst iat=419, 424, r3=2.900000, r4=3.400000, &end
# Atom 1: HB2 ASN 31, Atom 2: HND2 ASN 31
 &rst iat=419, 425, r3=3.500000, r4=4.000000, &end
# Atom 1: HB2 ASN 31, Atom 2: HN SER 32
 &rst iat=419, 429, r3=5.000000, r4=5.500000, &end
# Atom 1: HB3 ASN 31, Atom 2: HND1 ASN 31
 &rst iat=420, 424, r3=3.400000, r4=3.900000, &end
# Atom 1: HB3 ASN 31, Atom 2: HND2 ASN 31
 &rst iat=420, 425, r3=4.000000, r4=4.500000, &end
# Atom 1: HB3 ASN 31, Atom 2: HN SER 32
 &rst iat=420, 429, r3=5.800000, r4=6.300000, &end
# Atom 1: HND1 ASN 31, Atom 2: HN SER 32
 &rst iat=424, 429, r3=6.000000, r4=6.500000, &end
# Atom 1: HN SER 32, Atom 2: HA SER 32
 &rst iat=429, 431, r3=3.900000, r4=4.400000, &end
# Atom 1: HN SER 32, Atom 2: HB2 SER 32
 &rst iat=429, 433, r3=3.700000, r4=4.200000, &end
# Atom 1: HN SER 32, Atom 2: HB3 SER 32
 &rst iat=429, 434, r3=4.300000, r4=4.800000, &end
# Atom 1: HN SER 32, Atom 2: HA ASP 33
 &rst iat=429, 442, r3=6.000000, r4=6.500000, &end
# Atom 1: HN SER 32, Atom 2: HN LYS 35
 &rst iat=429, 464, r3=5.600000, r4=6.100000, &end
# Atom 1: HN SER 32, Atom 2: HB2 LYS 35
 &rst iat=429, 468, r3=5.300000, r4=5.800000, &end
# Atom 1: HN SER 32, Atom 2: HB2 CYS 36
 &rst iat=429, 490, r3=6.000000, r4=6.500000, &end
# Atom 1: HA SER 32, Atom 2: HB2 SER 32
 &rst iat=431, 433, r3=3.700000, r4=4.200000, &end
# Atom 1: HA SER 32, Atom 2: HB3 SER 32
 &rst iat=431, 434, r3=3.900000, r4=4.400000, &end
# Atom 1: HA SER 32, Atom 2: HN ASP 33
 &rst iat=431, 440, r3=3.400000, r4=3.900000, &end
# Atom 1: HA SER 32, Atom 2: HN ASP 34
 &rst iat=431, 452, r3=4.200000, r4=4.700000, &end
# Atom 1: HB2 SER 32, Atom 2: HN ASP 33
 &rst iat=433, 440, r3=4.500000, r4=5.000000, &end
# Atom 1: HB2 SER 32, Atom 2: HN LYS 35
 &rst iat=433, 464, r3=4.700000, r4=5.200000, &end
# Atom 1: HB2 SER 32, Atom 2: HB2 LYS 35
 &rst iat=433, 468, r3=4.200000, r4=4.700000, &end
# Atom 1: HB2 SER 32, Atom 2: HB3 LYS 35
 &rst iat=433, 469, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 SER 32, Atom 2: HG3 LYS 35
 &rst iat=433, 472, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 SER 32, Atom 2: HN CYS 36
 &rst iat=433, 486, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 SER 32, Atom 2: HN ASP 33
 &rst iat=434, 440, r3=3.800000, r4=4.300000, &end
# Atom 1: HB3 SER 32, Atom 2: HA ASP 33
 &rst iat=434, 442, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 SER 32, Atom 2: HN LYS 35
 &rst iat=434, 464, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 SER 32, Atom 2: HB2 LYS 35
 &rst iat=434, 468, r3=4.600000, r4=5.100000, &end
# Atom 1: HB3 SER 32, Atom 2: HG2 LYS 35
 &rst iat=434, 471, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 SER 32, Atom 2: HG3 LYS 35
 &rst iat=434, 472, r3=4.500000, r4=5.000000, &end
# Atom 1: HN ASP 33, Atom 2: HA ASP 33
 &rst iat=440, 442, r3=5.600000, r4=6.100000, &end
# Atom 1: HN ASP 33, Atom 2: HB2 ASP 33
 &rst iat=440, 444, r3=4.400000, r4=4.900000, &end
# Atom 1: HN ASP 33, Atom 2: HB3 ASP 33
 &rst iat=440, 445, r3=5.400000, r4=5.900000, &end
# Atom 1: HN ASP 33, Atom 2: HN ASP 34
 &rst iat=440, 452, r3=4.900000, r4=5.400000, &end
# Atom 1: HA ASP 33, Atom 2: HB2 ASP 33
 &rst iat=442, 444, r3=4.100000, r4=4.600000, &end
# Atom 1: HA ASP 33, Atom 2: HB3 ASP 33
 &rst iat=442, 445, r3=3.400000, r4=3.900000, &end
# Atom 1: HA ASP 33, Atom 2: HN ASP 34
 &rst iat=442, 452, r3=4.800000, r4=5.300000, &end
# Atom 1: HA ASP 33, Atom 2: HN LYS 35
 &rst iat=442, 464, r3=5.500000, r4=6.000000, &end
# Atom 1: HA ASP 33, Atom 2: HN CYS 36
 &rst iat=442, 486, r3=5.200000, r4=5.700000, &end
# Atom 1: HA ASP 33, Atom 2: HB2 CYS 36
 &rst iat=442, 490, r3=3.400000, r4=3.900000, &end
# Atom 1: HA ASP 33, Atom 2: HB3 CYS 36
 &rst iat=442, 491, r3=3.300000, r4=3.800000, &end
# Atom 1: HB2 ASP 33, Atom 2: HN ASP 34
 &rst iat=444, 452, r3=4.300000, r4=4.800000, &end
# Atom 1: HB3 ASP 33, Atom 2: HN ASP 34
 &rst iat=445, 452, r3=4.900000, r4=5.400000, &end
# Atom 1: HN ASP 34, Atom 2: HA ASP 34
 &rst iat=452, 454, r3=4.200000, r4=4.700000, &end
# Atom 1: HN ASP 34, Atom 2: HB2 ASP 34
 &rst iat=452, 456, r3=3.800000, r4=4.300000, &end
# Atom 1: HN ASP 34, Atom 2: HB3 ASP 34
 &rst iat=452, 457, r3=4.100000, r4=4.600000, &end
# Atom 1: HN ASP 34, Atom 2: HN LYS 35
 &rst iat=452, 464, r3=4.100000, r4=4.600000, &end
# Atom 1: HN ASP 34, Atom 2: HA LYS 35
 &rst iat=452, 466, r3=6.000000, r4=6.500000, &end
# Atom 1: HN ASP 34, Atom 2: HB2 LYS 35
 &rst iat=452, 468, r3=6.000000, r4=6.500000, &end
# Atom 1: HN ASP 34, Atom 2: HN CYS 36
 &rst iat=452, 486, r3=5.300000, r4=5.800000, &end
# Atom 1: HA ASP 34, Atom 2: HB2 ASP 34
 &rst iat=454, 456, r3=3.600000, r4=4.100000, &end
# Atom 1: HA ASP 34, Atom 2: HB3 ASP 34
 &rst iat=454, 457, r3=3.300000, r4=3.800000, &end
# Atom 1: HA ASP 34, Atom 2: HN LYS 35
 &rst iat=454, 464, r3=4.300000, r4=4.800000, &end
# Atom 1: HA ASP 34, Atom 2: HN CYS 36
 &rst iat=454, 486, r3=4.600000, r4=5.100000, &end
# Atom 1: HA ASP 34, Atom 2: HB3 CYS 36
 &rst iat=454, 491, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 ASP 34, Atom 2: HN LYS 35
 &rst iat=456, 464, r3=5.300000, r4=5.800000, &end
# Atom 1: HB2 ASP 34, Atom 2: HN CYS 36
 &rst iat=456, 486, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 ASP 34, Atom 2: HN LYS 35
 &rst iat=457, 464, r3=5.200000, r4=5.700000, &end
# Atom 1: HB3 ASP 34, Atom 2: HN CYS 36
 &rst iat=457, 486, r3=5.800000, r4=6.300000, &end
# Atom 1: HN LYS 35, Atom 2: HA LYS 35
 &rst iat=464, 466, r3=3.900000, r4=4.400000, &end
# Atom 1: HN LYS 35, Atom 2: HB2 LYS 35
 &rst iat=464, 468, r3=4.100000, r4=4.600000, &end
# Atom 1: HN LYS 35, Atom 2: HB3 LYS 35
 &rst iat=464, 469, r3=4.500000, r4=5.000000, &end
# Atom 1: HN LYS 35, Atom 2: HG2 LYS 35
 &rst iat=464, 471, r3=3.700000, r4=4.200000, &end
# Atom 1: HN LYS 35, Atom 2: HG3 LYS 35
 &rst iat=464, 472, r3=4.000000, r4=4.500000, &end
# Atom 1: HN LYS 35, Atom 2: QD LYS 35
 &rst iat=464, -1, r3=7.000000, r4=7.500000, igr2=474, 475, &end
# Atom 1: HN LYS 35, Atom 2: QE LYS 35
 &rst iat=464, -1, r3=7.000000, r4=7.500000, igr2=477, 478, &end
# Atom 1: HN LYS 35, Atom 2: HN CYS 36
 &rst iat=464, 486, r3=3.400000, r4=3.900000, &end
# Atom 1: HN LYS 35, Atom 2: HA CYS 36
 &rst iat=464, 488, r3=6.000000, r4=6.500000, &end
# Atom 1: HN LYS 35, Atom 2: HB2 CYS 36
 &rst iat=464, 490, r3=6.000000, r4=6.500000, &end
# Atom 1: HN LYS 35, Atom 2: HB3 CYS 36
 &rst iat=464, 491, r3=6.000000, r4=6.500000, &end
# Atom 1: HA LYS 35, Atom 2: HB2 LYS 35
 &rst iat=466, 468, r3=3.500000, r4=4.000000, &end
# Atom 1: HA LYS 35, Atom 2: HB3 LYS 35
 &rst iat=466, 469, r3=3.300000, r4=3.800000, &end
# Atom 1: HA LYS 35, Atom 2: HG2 LYS 35
 &rst iat=466, 471, r3=3.100000, r4=3.600000, &end
# Atom 1: HA LYS 35, Atom 2: HG3 LYS 35
 &rst iat=466, 472, r3=3.600000, r4=4.100000, &end
# Atom 1: HA LYS 35, Atom 2: QD LYS 35
 &rst iat=466, -1, r3=4.900000, r4=5.400000, igr2=474, 475, &end
# Atom 1: HA LYS 35, Atom 2: QE LYS 35
 &rst iat=466, -1, r3=7.000000, r4=7.500000, igr2=477, 478, &end
# Atom 1: HA LYS 35, Atom 2: HN CYS 36
 &rst iat=466, 486, r3=4.100000, r4=4.600000, &end
# Atom 1: HA LYS 35, Atom 2: HA CYS 36
 &rst iat=466, 488, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 LYS 35, Atom 2: HG2 LYS 35
 &rst iat=468, 471, r3=3.300000, r4=3.800000, &end
# Atom 1: HB2 LYS 35, Atom 2: HG3 LYS 35
 &rst iat=468, 472, r3=2.500000, r4=3.000000, &end
# Atom 1: HB2 LYS 35, Atom 2: QE LYS 35
 &rst iat=468, -1, r3=4.900000, r4=5.400000, igr2=477, 478, &end
# Atom 1: HB2 LYS 35, Atom 2: HN CYS 36
 &rst iat=468, 486, r3=5.100000, r4=5.600000, &end
# Atom 1: HB3 LYS 35, Atom 2: HG2 LYS 35
 &rst iat=469, 471, r3=2.700000, r4=3.200000, &end
# Atom 1: HB3 LYS 35, Atom 2: HG3 LYS 35
 &rst iat=469, 472, r3=3.100000, r4=3.600000, &end
# Atom 1: HB3 LYS 35, Atom 2: QD LYS 35
 &rst iat=469, -1, r3=4.600000, r4=5.100000, igr2=474, 475, &end
# Atom 1: HB3 LYS 35, Atom 2: QE LYS 35
 &rst iat=469, -1, r3=5.800000, r4=6.300000, igr2=477, 478, &end
# Atom 1: HB3 LYS 35, Atom 2: HN CYS 36
 &rst iat=469, 486, r3=5.600000, r4=6.100000, &end
# Atom 1: HG2 LYS 35, Atom 2: QD LYS 35
 &rst iat=471, -1, r3=4.300000, r4=4.800000, igr2=474, 475, &end
# Atom 1: HG2 LYS 35, Atom 2: QE LYS 35
 &rst iat=471, -1, r3=4.900000, r4=5.400000, igr2=477, 478, &end
# Atom 1: HG2 LYS 35, Atom 2: HN CYS 36
 &rst iat=471, 486, r3=5.200000, r4=5.700000, &end
# Atom 1: HG3 LYS 35, Atom 2: QD LYS 35
 &rst iat=472, -1, r3=4.000000, r4=4.500000, igr2=474, 475, &end
# Atom 1: HG3 LYS 35, Atom 2: QE LYS 35
 &rst iat=472, -1, r3=5.100000, r4=5.600000, igr2=477, 478, &end
# Atom 1: HG3 LYS 35, Atom 2: HN CYS 36
 &rst iat=472, 486, r3=6.000000, r4=6.500000, &end
# Atom 1: QD LYS 35, Atom 2: QE LYS 35
 &rst iat=-1, -1, r3=5.500000, r4=6.000000, 
 igr1=474, 475, igr2=477, 478, &end
# Atom 1: HN CYS 36, Atom 2: HA CYS 36
 &rst iat=486, 488, r3=4.000000, r4=4.500000, &end
# Atom 1: HN CYS 36, Atom 2: HB2 CYS 36
 &rst iat=486, 490, r3=3.600000, r4=4.100000, &end
# Atom 1: HN CYS 36, Atom 2: HB3 CYS 36
 &rst iat=486, 491, r3=3.300000, r4=3.800000, &end
# Atom 1: HN CYS 36, Atom 2: HA PRO 37
 &rst iat=486, 508, r3=6.000000, r4=6.500000, &end
# Atom 1: HN CYS 36, Atom 2: HD2 PRO 37
 &rst iat=486, 500, r3=5.600000, r4=6.100000, &end
# Atom 1: HN CYS 36, Atom 2: HD3 PRO 37
 &rst iat=486, 499, r3=4.700000, r4=5.200000, &end
# Atom 1: HN CYS 36, Atom 2: HN CYS 38
 &rst iat=486, 512, r3=5.400000, r4=5.900000, &end
# Atom 1: HA CYS 36, Atom 2: HB2 CYS 36
 &rst iat=488, 490, r3=3.500000, r4=4.000000, &end
# Atom 1: HA CYS 36, Atom 2: HB3 CYS 36
 &rst iat=488, 491, r3=4.000000, r4=4.500000, &end
# Atom 1: HA CYS 36, Atom 2: HG2 PRO 37
 &rst iat=488, 503, r3=4.400000, r4=4.900000, &end
# Atom 1: HA CYS 36, Atom 2: HG3 PRO 37
 &rst iat=488, 502, r3=4.700000, r4=5.200000, &end
# Atom 1: HA CYS 36, Atom 2: HD2 PRO 37
 &rst iat=488, 500, r3=3.600000, r4=4.100000, &end
# Atom 1: HA CYS 36, Atom 2: HD3 PRO 37
 &rst iat=488, 499, r3=3.100000, r4=3.600000, &end
# Atom 1: HA CYS 36, Atom 2: HN CYS 38
 &rst iat=488, 512, r3=5.300000, r4=5.800000, &end
# Atom 1: HA CYS 36, Atom 2: HB2 CYS 38
 &rst iat=488, 516, r3=5.000000, r4=5.500000, &end
# Atom 1: HB2 CYS 36, Atom 2: HD2 PRO 37
 &rst iat=490, 500, r3=5.000000, r4=5.500000, &end
# Atom 1: HB2 CYS 36, Atom 2: HD3 PRO 37
 &rst iat=490, 499, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 CYS 36, Atom 2: HN CYS 38
 &rst iat=490, 512, r3=6.000000, r4=6.500000, &end
# Atom 1: HB3 CYS 36, Atom 2: HN CYS 38
 &rst iat=491, 512, r3=6.000000, r4=6.500000, &end
# Atom 1: HA PRO 37, Atom 2: HB2 PRO 37
 &rst iat=508, 506, r3=4.600000, r4=5.100000, &end
# Atom 1: HA PRO 37, Atom 2: HB3 PRO 37
 &rst iat=508, 505, r3=4.000000, r4=4.500000, &end
# Atom 1: HA PRO 37, Atom 2: HG3 PRO 37
 &rst iat=508, 502, r3=3.800000, r4=4.300000, &end
# Atom 1: HA PRO 37, Atom 2: HN CYS 38
 &rst iat=508, 512, r3=3.900000, r4=4.400000, &end
# Atom 1: HA PRO 37, Atom 2: HB3 CYS 38
 &rst iat=508, 517, r3=5.800000, r4=6.300000, &end
# Atom 1: HB2 PRO 37, Atom 2: HG2 PRO 37
 &rst iat=506, 503, r3=2.700000, r4=3.200000, &end
# Atom 1: HB2 PRO 37, Atom 2: HG3 PRO 37
 &rst iat=506, 502, r3=2.700000, r4=3.200000, &end
# Atom 1: HB2 PRO 37, Atom 2: HD2 PRO 37
 &rst iat=506, 500, r3=6.000000, r4=6.500000, &end
# Atom 1: HB2 PRO 37, Atom 2: HD3 PRO 37
 &rst iat=506, 499, r3=4.700000, r4=5.200000, &end
# Atom 1: HB2 PRO 37, Atom 2: HN CYS 38
 &rst iat=506, 512, r3=5.800000, r4=6.300000, &end
# Atom 1: HB2 PRO 37, Atom 2: HA CYS 38
 &rst iat=506, 514, r3=5.000000, r4=5.500000, &end
# Atom 1: HB3 PRO 37, Atom 2: HG2 PRO 37
 &rst iat=505, 503, r3=3.100000, r4=3.600000, &end
# Atom 1: HB3 PRO 37, Atom 2: HG3 PRO 37
 &rst iat=505, 502, r3=2.600000, r4=3.100000, &end
# Atom 1: HB3 PRO 37, Atom 2: HD2 PRO 37
 &rst iat=505, 500, r3=5.100000, r4=5.600000, &end
# Atom 1: HB3 PRO 37, Atom 2: HD3 PRO 37
 &rst iat=505, 499, r3=3.600000, r4=4.100000, &end
# Atom 1: HB3 PRO 37, Atom 2: HN CYS 38
 &rst iat=505, 512, r3=4.500000, r4=5.000000, &end
# Atom 1: HG2 PRO 37, Atom 2: HD2 PRO 37
 &rst iat=503, 500, r3=3.200000, r4=3.700000, &end
# Atom 1: HG2 PRO 37, Atom 2: HD3 PRO 37
 &rst iat=503, 499, r3=2.900000, r4=3.400000, &end
# Atom 1: HG2 PRO 37, Atom 2: HN CYS 38
 &rst iat=503, 512, r3=5.400000, r4=5.900000, &end
# Atom 1: HG3 PRO 37, Atom 2: HD2 PRO 37
 &rst iat=502, 500, r3=3.000000, r4=3.500000, &end
# Atom 1: HG3 PRO 37, Atom 2: HD3 PRO 37
 &rst iat=502, 499, r3=3.400000, r4=3.900000, &end
# Atom 1: HG3 PRO 37, Atom 2: HN CYS 38
 &rst iat=502, 512, r3=4.600000, r4=5.100000, &end
# Atom 1: HD2 PRO 37, Atom 2: HN CYS 38
 &rst iat=500, 512, r3=3.600000, r4=4.100000, &end
# Atom 1: HD2 PRO 37, Atom 2: HB2 CYS 38
 &rst iat=500, 516, r3=4.800000, r4=5.300000, &end
# Atom 1: HD3 PRO 37, Atom 2: HN CYS 38
 &rst iat=499, 512, r3=4.400000, r4=4.900000, &end
# Atom 1: HN CYS 38, Atom 2: HA CYS 38
 &rst iat=512, 514, r3=3.900000, r4=4.400000, &end
# Atom 1: HN CYS 38, Atom 2: HB2 CYS 38
 &rst iat=512, 516, r3=2.900000, r4=3.400000, &end
# Atom 1: HN CYS 38, Atom 2: HB3 CYS 38
 &rst iat=512, 517, r3=3.400000, r4=3.900000, &end
# Atom 1: HN CYS 38, Atom 2: HN GLY 39
 &rst iat=512, 524, r3=4.900000, r4=5.400000, &end
# Atom 1: HN CYS 38, Atom 2: HN ASN 40
 &rst iat=512, 531, r3=5.600000, r4=6.100000, &end
# Atom 1: HA CYS 38, Atom 2: HB2 CYS 38
 &rst iat=514, 516, r3=3.700000, r4=4.200000, &end
# Atom 1: HA CYS 38, Atom 2: HB3 CYS 38
 &rst iat=514, 517, r3=4.000000, r4=4.500000, &end
# Atom 1: HA CYS 38, Atom 2: HN GLY 39
 &rst iat=514, 524, r3=3.300000, r4=3.800000, &end
# Atom 1: HA CYS 38, Atom 2: HN ASN 40
 &rst iat=514, 531, r3=5.400000, r4=5.900000, &end
# Atom 1: HB2 CYS 38, Atom 2: HN GLY 39
 &rst iat=516, 524, r3=5.100000, r4=5.600000, &end
# Atom 1: HB2 CYS 38, Atom 2: HN ASN 40
 &rst iat=516, 531, r3=5.800000, r4=6.300000, &end
# Atom 1: HB3 CYS 38, Atom 2: HN GLY 39
 &rst iat=517, 524, r3=4.200000, r4=4.700000, &end
# Atom 1: HB3 CYS 38, Atom 2: HN ASN 40
 &rst iat=517, 531, r3=4.400000, r4=4.900000, &end
# Atom 1: HN GLY 39, Atom 2: HA2 GLY 39
 &rst iat=524, 526, r3=3.800000, r4=4.300000, &end
# Atom 1: HN GLY 39, Atom 2: HA3 GLY 39
 &rst iat=524, 527, r3=3.500000, r4=4.000000, &end
# Atom 1: HN GLY 39, Atom 2: HN ASN 40
 &rst iat=524, 531, r3=3.700000, r4=4.200000, &end
# Atom 1: HN GLY 39, Atom 2: HA ASN 40
 &rst iat=524, 533, r3=5.500000, r4=6.000000, &end
# Atom 1: HN GLY 39, Atom 2: HND1 ASN 40
 &rst iat=524, 540, r3=4.000000, r4=4.500000, &end
# Atom 1: HA2 GLY 39, Atom 2: HN ASN 40
 &rst iat=526, 531, r3=4.700000, r4=5.200000, &end
# Atom 1: HA2 GLY 39, Atom 2: HND2 ASN 40
 &rst iat=526, 541, r3=5.900000, r4=6.400000, &end
# Atom 1: HA3 GLY 39, Atom 2: HN ASN 40
 &rst iat=527, 531, r3=4.300000, r4=4.800000, &end
# Atom 1: HN ASN 40, Atom 2: HA ASN 40
 &rst iat=531, 533, r3=4.400000, r4=4.900000, &end
# Atom 1: HN ASN 40, Atom 2: HB2 ASN 40
 &rst iat=531, 535, r3=3.700000, r4=4.200000, &end
# Atom 1: HN ASN 40, Atom 2: HB3 ASN 40
 &rst iat=531, 536, r3=4.300000, r4=4.800000, &end
# Atom 1: HN ASN 40, Atom 2: HND1 ASN 40
 &rst iat=531, 540, r3=4.000000, r4=4.500000, &end
# Atom 1: HN ASN 40, Atom 2: HND2 ASN 40
 &rst iat=531, 541, r3=5.300000, r4=5.800000, &end
# Atom 1: HA ASN 40, Atom 2: HB2 ASN 40
 &rst iat=533, 535, r3=3.900000, r4=4.400000, &end
# Atom 1: HA ASN 40, Atom 2: HB3 ASN 40
 &rst iat=533, 536, r3=3.900000, r4=4.400000, &end
# Atom 1: HA ASN 40, Atom 2: HND1 ASN 40
 &rst iat=533, 540, r3=4.300000, r4=4.800000, &end
# Atom 1: HA ASN 40, Atom 2: HND2 ASN 40
 &rst iat=533, 541, r3=5.400000, r4=5.900000, &end
# Atom 1: HB2 ASN 40, Atom 2: HND1 ASN 40
 &rst iat=535, 540, r3=3.100000, r4=3.600000, &end
# Atom 1: HB2 ASN 40, Atom 2: HND2 ASN 40
 &rst iat=535, 541, r3=3.800000, r4=4.300000, &end
# Atom 1: HB3 ASN 40, Atom 2: HND1 ASN 40
 &rst iat=536, 540, r3=3.400000, r4=3.900000, &end
# Atom 1: HB3 ASN 40, Atom 2: HND2 ASN 40
 &rst iat=536, 541, r3=4.100000, r4=4.600000, &end
# Final blank line
 &rst iat=0, 0, r3=0, r4=0, &end



Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Monday, January 22, 2018 10:24:01 AM CST (wattos1)